Company lists · Data refreshed September 2026

Top 25 Cheminformatics software companies worldwide

Name: Cheminformatics software companies worldwide
Creator: RevenueBase
License: https://creativecommons.org/licenses/by/4.0/

Compiled by the RevenueBase Data Team Data refreshed Sep 27, 2026 2,050 companies tracked

RevenueBase identified 2,050 cheminformatics software companies worldwide as of September 2026 and tracks 46,735 professional contacts across them, including 14,975 with verified work emails. The United States is the largest market and Hyderabad the largest hub.

This list covers cheminformatics software companies worldwide, matched on what each company actually does as described in its own words. Ranked by team size, largest first. Every row shows the company's own description, its RevenueBase Smart Search rating, and when it was last checked. Data refreshed September 27, 2026. Country and city lists for cheminformatics software companies follow the table.

Published by RevenueBase, a B2B data infrastructure company. This list was built with RevenueBase Smart Search, the natural-language company search RevenueBase customers use to build their own targeted lists and unlock verified emails and direct dials at the companies on them. How these lists are built and judged.

How to read this list HQ checked on every row RevenueBase Smart Search rating on every row Refreshed Sep 27, 2026 86% judged on-target in blind review

2,050Companies

46,735Contacts tracked

14,975Verified emails

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The 25 largest cheminformatics software companies worldwide

Ranked by team size

Top 25 of 2,050 cheminformatics software companies worldwide, ranked by team size, largest first. Data refreshed Sep 27, 2026. RevenueBase Smart Search rates how each company's information relates to cheminformatics software companies: strong evidence (its own description names it), partial (names part of it), indirect (matched on the rest of its profile rather than the description shown). Click a contact count to view that company's people.
#	Company	RevenueBase Smart Search	Headquarters	Employees	Contacts
1	CAS	Indirect evidence	Columbus, OH, United StatesHQ checked Sep 27, 2026	1,001-5,000	2,898 contacts →
	Indirect evidence “CAS is a leader in scientific information solutions and a division of the American Chemical Society.” Source: RevenueBase Database · checked Sep 27, 2026
2	Anthem Biosciences Limited	Indirect evidence	Bangalore, IndiaHQ checked Sep 27, 2026	1,001-5,000	2,336 contacts →
	Indirect evidence “Anthem Biosciences, a Bangalore-India based Contract Research Development Organization (CDMO) Anthem Bio offers a whole gamut of services dedicated to enabling and sustaining…” Source: RevenueBase Database · checked Sep 27, 2026
3	Arisglobal	Indirect evidence	Waltham, MA, United StatesHQ checked Sep 27, 2026	1,001-5,000	1,905 contacts →
	Indirect evidence “ArisGlobal is an AI-first technology company at the forefront of life sciences and the creator of LifeSphere®, the platform trusted by hundreds of life sciences organizations…” Source: RevenueBase Database · checked Sep 27, 2026
4	Certara	Partial evidence	Radnor, PA, United StatesHQ checked Sep 27, 2026	1,001-5,000	1,237 contacts →
	Partial evidence “Certara accelerates medicines using proprietary biosimulation software, technology and services to transform traditional drug discovery and development.” Source: RevenueBase Database · checked Sep 27, 2026
5	Navin Fluorine International LTD	Indirect evidence	Mumbai, IndiaHQ checked Sep 27, 2026	1,001-5,000	1,229 contacts →
	Indirect evidence “Navin Fluorine International Ltd (NFIL) is a reliable global leader offering organo-fluorine chemistry expertise for nearly 50 years with operations in UK & India, that spans…” Source: RevenueBase Database · checked Sep 27, 2026
6	TCG Lifesciences PVT LTD	Indirect evidence	Kolkata, IndiaHQ checked Sep 27, 2026	1,001-5,000	1,019 contacts →
	Indirect evidence “TCG Lifesciences Pvt.” Source: RevenueBase Database · checked Sep 27, 2026
7	Schrödinger	Indirect evidence	New York, NY, United StatesHQ checked Sep 27, 2026	501-1,000	957 contacts →
	Indirect evidence “Schrödinger’s industry-leading computational platform facilitates the research efforts of biopharmaceutical and industrial companies, academic institutions, and government…” Source: RevenueBase Database · checked Sep 27, 2026
8	Excelra	Indirect evidence	Iselin, NJ, United StatesHQ checked Sep 27, 2026	501-1,000	894 contacts →
	Indirect evidence “Discover how Excelra, a leader in biopharma data and analytics, uniquely blends scientific understanding with technological expertise.” Source: RevenueBase Database · checked Sep 27, 2026
9	Aptuit	Indirect evidence	Verona, ItalyHQ checked Sep 27, 2026	501-1,000	678 contacts →
	Indirect evidence “Aptuit, an Evotec company, is a pharmaceutical services provider that offers the most complete set of integrated early discovery to mid-phase drug development solutions by…” Source: RevenueBase Database · checked Sep 27, 2026
10	Phenomenex	Indirect evidence	Torrance, CA, United StatesHQ checked Sep 27, 2026	1,001-5,000	660 contacts →
	Indirect evidence “Phenomenex is a global technology leader committed to developing novel analytical chemistry solutions that solve the separation and purification challenges of researchers in…” Source: RevenueBase Database · checked Sep 27, 2026
11	O2h Discovery	Indirect evidence	Cambridge, United KingdomHQ checked Sep 27, 2026	501-1,000	521 contacts →
	Indirect evidence “Founded in 2005, o2h discovery is a Contract Research Organisation which has an integrated drug discovery platform operating from our state-of-the-art research centre in India and…” Source: RevenueBase Database · checked Sep 27, 2026
12	Dotmatics	Partial evidence	Boston, MA, United StatesHQ checked Sep 27, 2026	501-1,000	405 contacts →
	Partial evidence “Dotmatics is the global leader in R&D scientific software that connects science, data, and decision-making.” Source: RevenueBase Database · checked Sep 27, 2026
13	Novasep	Indirect evidence	Lyon, FranceHQ checked Sep 27, 2026	1,001-5,000	396 contacts →
	Indirect evidence “Novasep is a leading provider of services in the field of molecule production and purification for the life science industries, based on an unrivalled pool of specialized and…” Source: RevenueBase Database · checked Sep 27, 2026
14	CABB	Indirect evidence	Sulzbach Am Taunus, GermanyHQ checked Sep 27, 2026	1,001-5,000	394 contacts →
	Indirect evidence “CABB Group is a leading contract development and manufacturing company (CDMO) for starting materials, active ingredients and advanced intermediates.” Source: RevenueBase Database · checked Sep 27, 2026
15	Gilson	Indirect evidence	Middleton, WI, United StatesHQ checked Sep 27, 2026	501-1,000	389 contacts →
	Indirect evidence “Gilson provides high quality, dependable solutions for today's demanding liquid chromatography, solid phase extraction, liquid handling and gel permeation chromatography clean-up…” Source: RevenueBase Database · checked Sep 27, 2026
16	Genedata	Indirect evidence	Basel, SwitzerlandHQ checked Sep 27, 2026	201-500	386 contacts →
	Indirect evidence “Genedata transforms biopharma data into intelligence.” Source: RevenueBase Database · checked Sep 27, 2026
17	Symeres	Indirect evidence	Nijmegen, NetherlandsHQ checked Sep 27, 2026	501-1,000	377 contacts →
	Indirect evidence “Symeres is a leading contract research, development and manufacturing organization (CDMO & CRO) supporting pharmaceutical and biotechnology companies across the full drug…” Source: RevenueBase Database · checked Sep 27, 2026
18	Velsera	Indirect evidence	Charlestown, MA, United StatesHQ checked Sep 27, 2026	501-1,000	369 contacts →
	Indirect evidence “Velsera was formed in 2023 through the shared vision of Seven Bridges and Pierian, with a mission to accelerate the discovery, development, and delivery of life-changing insights.” Source: RevenueBase Database · checked Sep 27, 2026
19	Enveda	Indirect evidence	Boulder, United StatesHQ checked Sep 27, 2026	201-500	360 contacts →
	Indirect evidence “Enveda is a biotechnology company that is learning from life’s chemistry to create better medicines faster.” Source: RevenueBase Database · checked Sep 27, 2026
20	Sitec Labs PVT LTD	Indirect evidence	Navi Mumbai, IndiaHQ checked Sep 27, 2026	n/a	360 contacts →
	Indirect evidence “has been servicing customers across the globe have synthesized more than 500 impurities as on date.” Source: RevenueBase Database · checked Sep 27, 2026
21	Inventys Research Company	Indirect evidence	Mumbai, IndiaHQ checked Sep 27, 2026	201-500	359 contacts →
	Indirect evidence “Inventys Research Company provides Exclusive Synthesis & CDMO services to innovators in Crop Protection, Specialty chemicals, and pharmaceutical industries.” Source: RevenueBase Database · checked Sep 27, 2026
22	Jubilant Chemsys	Indirect evidence	Noida, IndiaHQ checked Sep 27, 2026	501-1,000	353 contacts →
	Indirect evidence “Jubilant Chemsys Ltd (JCL); a company registered under the Indian Companies Act, 1956 offers services in synthetic, organic and medicinal chemistry areas to various pharmaceutical…” Source: RevenueBase Database · checked Sep 27, 2026
23	Scimplify	Indirect evidence	Bengaluru, IndiaHQ checked Sep 27, 2026	201-500	340 contacts →
	Indirect evidence “Scimplify is a full-stack platform for research, development, and manufacturing of specialty chemicals.” Source: RevenueBase Database · checked Sep 27, 2026
24	Aether Industries Limited	Indirect evidence	Surat, IndiaHQ checked Sep 27, 2026	501-1,000	335 contacts →
	Indirect evidence “The business model of the India based Aether Industries Limited is to be a leading global manufacturer of fine and specialty chemicals and active ingredients, as well as a…” Source: RevenueBase Database · checked Sep 27, 2026
25	Laxai Life Sciences	Indirect evidence	Hyderabad, IndiaHQ checked Sep 27, 2026	501-1,000	311 contacts →
	Indirect evidence “LAXAI Life Sciences is a leading small molecule CRDMO providing end-to-end Integrated Drug Discovery, Development, and Manufacturing solutions to the pharmaceutical and biotech…” Source: RevenueBase Database · checked Sep 27, 2026

RevenueBase Smart Search

RevenueBase Smart Search assesses information from a company’s LinkedIn profile, information supplied directly by the company, its website, and other publicly available sources. It uses that information to rate how closely the company relates to this list’s category: cheminformatics software companies. Every row carries its rating and the description the rating was read from, so each one can be checked rather than taken on trust.

Strong evidence: The company's own public description of its business names cheminformatics software companies.
Partial evidence: Its own public description names part of cheminformatics software companies, so it works in or next to the category without describing itself that way.
Indirect evidence: The description shown does not name cheminformatics software companies. The match rests on the rest of the company's public profile rather than the one sentence quoted here, so this is the rating to check first.

RevenueBase Smart Search is how these lists are built: RevenueBase's data engine and AI assemble the companies that match a category defined in a user's own words, so a list can be about what companies actually do rather than about whichever industry code they were filed under.

Showing 25 of 2,050 cheminformatics software companies worldwide

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Cheminformatics software companies worldwide at a glance

As of Sep 27, 2026

32.0%Verified-email coverage

22.8Average contacts per company

11-50Median size (employees)

3.8%Largest-city concentration · Hyderabad

Sep 27, 2026Page data refreshed

Companies by employee count

1-10

959

11-50

678

51-200

271

201-500

501-1,000

1,001-5,000

5,001-10,000

10001+

Email recency is reported on each country list linked below.

How this list was built

Company categories are rarely black and white. RevenueBase reads each company's own description of its business to decide whether it belongs among cheminformatics software companies, so some rows will be adjacent to the category rather than pure plays. The description and RevenueBase Smart Search rating on every row are there so you can check each match yourself.

Source: The RevenueBase company graph: 60 million companies and 398.9 million professional contacts resolved from primary sources, queried with RevenueBase Smart Search, the natural-language company search available to every RevenueBase user.
Coverage: Every country. Country and city lists for cheminformatics software companies are linked below.
What qualifies: Companies worldwide whose own description of what they do matches “cheminformatics software companies”. Matching reads each company's description, not its industry code or its name.
RevenueBase Smart Search: RevenueBase Smart Search is how this list is assembled and how each row is rated. RevenueBase's data engine and AI assess a company's LinkedIn profile, information supplied directly by the company, its website and other publicly available information, then relate it to a category defined in a user's own words. Each row is rated strong evidence (its own description names cheminformatics software companies), partial evidence (it names part of the category) or indirect evidence (the description shown names none of it and the match rests on the rest of the company's profile). The description supporting each rating is quoted on the row.
What we exclude: Companies whose own description does not clearly place them among cheminformatics software companies, and records with no verified work email.
Match quality: In blind human judging of this matching method, 86% of matched companies were on target. Expect roughly 1 in 7 rows to be adjacent to the category rather than a pure play. Every row shows the company's own description and its RevenueBase Smart Search rating so you can judge each match yourself. Read the full methodology: how the lists are built, how the judging worked, and what the figure means.
Ranking: Team size, largest first: companies are ordered by the number of professionals RevenueBase tracks at each one. Employee ranges shown are reported bands, for context.
Verification: Every listed company carries at least one verified work email, 14,975 across the full list. Contacts re-verify on a rolling cadence, and each contact's own verification date is shown inside RevenueBase.
Refresh: This page's figures were pulled from the company graph on September 27, 2026. Lists refresh periodically as the graph is re-checked.
Corrections: Wrong category, wrong headquarters, or a company that has closed? Use “Report an issue” on any row. Reports go to the RevenueBase Data Team and feed back into the company graph.

Cheminformatics software companies by location

12 lists · largest first

Every Cheminformatics software companies list RevenueBase publishes, by country and city. Counts are matching companies in each list as of its own refresh date.

Countries

Frequently asked

What is RevenueBase Smart Search?

RevenueBase Smart Search is how RevenueBase decides which companies belong on this list and how strongly each one fits. Its data engine and AI assess a company's LinkedIn profile, information supplied directly by the company, its website and other publicly available information, then relate it to the category the list is about. Each row is rated strong evidence when the company's own description names cheminformatics software companies, partial evidence when it names part of the category, and indirect evidence when the description shown names none of it and the match rests on the rest of the company's profile.

How many cheminformatics software companies are there worldwide?

RevenueBase identified 2,050 cheminformatics software companies worldwide as of September 2026, matched on each company's own description of what it does rather than its industry code.

What is the largest company on this list?

CAS, headquartered in Columbus, tops this list with the largest team on record.

Which country has the most cheminformatics software companies?

The United States leads with 432 companies, followed by India (330) and China (173). Every cheminformatics software companies list by country and city is linked on this page.

Which city has the most cheminformatics software companies?

Hyderabad leads with 77 headquartered companies, followed by London (36) and San Diego (28).

How do I get contact information for these companies?

A free RevenueBase account lets you run this exact search and work the top results, verified emails and direct dials included. Upgrading unlocks all 14,975 verified decision-maker contacts tracked across these 2,050 companies.

How current is this list?

The list refreshes periodically as the company graph is re-checked. This page's figures were pulled on September 27, 2026.

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About this data

RevenueBase is a B2B data infrastructure company. Its company graph covers 60 million companies and 398.9 million professional contacts, with emails verified on a rolling cadence rather than scraped once and left to decay. These company lists are generated directly from that graph with RevenueBase Smart Search, the same natural-language company search every RevenueBase user has: describe a market in plain words, get the companies that match, and add verified emails and direct dials for the people at them. It is the same data that powers RevenueBase's B2B data products, and a free account includes 500 credits to start. How these lists are built and judged.