Benzoic Acid

Benzoic Acid

SCHEMBL720788

CC(C)C(O)C(C)(C)CO.O=C(O)c1ccccc1.O=C(O)c1ccccc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D

The experimentally established mechanism targets of Benzoic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.53
DAO P14920 1/20 0.47
TSHR P16473 1/20 0.47
NAPRT Q6XQN6 1/20 0.47
RXRA P19793 2/20 0.42
RXRB P28702 2/20 0.42
RXRG P48443 2/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
SRD5A2 P31213 1/20 0.41
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
VNN1 O95497 1/20 0.39
PKM P14618 1/20 0.39
MAPK1 P28482 2/20 0.38
ADRB1 P08588 2/20 0.37
ADRB3 P13945 2/20 0.37
ADRB2 P07550 1/20 0.37
NR4A1 P22736 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Benzoic Acid SCHEMBL721538 1.00 TRPA1 (0.53) TRPA1DAOTSHRNAPRTRXRA
Benzoic Acid SCHEMBL157373 0.95 TRPA1 (0.49) TRPA1DAOTSHRNAPRTRXRA
Benzoic Acid SCHEMBL23200506 0.95 TRPA1 (0.49) TRPA1DAOTSHRNAPRTRXRA
Benzoyl Formic Acid SCHEMBL16047491 0.93 TRPA1 (0.46) TRPA1DAOTSHRNAPRTRXRA
Isophthalic Acid SCHEMBL10943672 0.90 TRPA1 (0.46) TRPA1RXRARXRBNR4A1NR4A2
Benzoic Acid SCHEMBL272637 0.90 TRPA1 (0.44) TRPA1DAOTSHRNAPRTRXRA
Benzoic Acid SCHEMBL16045755 0.89 TRPA1 (0.43) TRPA1DAOTSHRNAPRTRXRA
Benzoic Acid SCHEMBL16044771 0.89 TRPA1 (0.43) TRPA1DAOTSHRNAPRTRXRA
Benzoic Acid SCHEMBL7624769 0.88 TRPA1 (0.42) TRPA1DAOTSHRNAPRTRXRA
Benzoic Acid SCHEMBL7630225 0.88 TRPA1 (0.42) TRPA1DAOTSHRNAPRTRXRA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 766 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260109795-A1 HIGH REFRACTIVE INDEX POLYVINYL ACETAL RESINS MODIFIED WITH CYCLIC ALDEHYDES EASTMAN CHEMICAL COMPANY (US) 2026-04-23 US claimed
US-12365785-B2 Glycol ether aryl ester plasticizer EASTMAN CHEMICAL COMPANY (US) 2025-07-22 US claimed
WO-2024076953-A1 HIGH REFRACTIVE INDEX POLYVINYL ACETAL RESINS MODIFIED WITH CYCLIC ALDEHYDES EASTMAN CHEMICAL COMPANY (US) 2024-04-11 WO claimed
CN-115975075-A Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2023-04-18 CN claimed
CN-111907155-B Intermediate film and laminated glass comprising same 长春石油化学股份有限公司 2023-01-24 CN claimed
US-20220227962-A1 GLYCOL ETHER ARYL ESTER PLASTICIZER EASTMAN CHEMICAL COMPANY (US) 2022-07-21 US claimed
EP-3990532-A1 GLYCOL ETHER ARYL ESTER PLASTICIZER Eastman Chemical Company (US) 2022-05-04 EP claimed
US-20210028444-A1 THIN FILM CERAMICS THAT OFFER ELECTRIC AND ELECTROCHEMICAL PROPERTIES USING NANOPOWDERS OF CONTROLLED COMPOSITIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-01-28 US claimed
WO-2021010911-A1 AN EASILY APPLICABLE HYDROPHOBIC COATING COMPOSITION TO IMPROVE MOISTURE AND WATER RESISTANCE OF THE LOCKING SYSTEMS OF THE LAMINATE FLOORING PARQUETS AGT AĞAÇ SANAYİ VE TİCARET ANONİM ŞİRKETİ (TR) 2021-01-21 WO claimed
WO-2020263593-A1 GLYCOL ETHER ARYL ESTER PLASTICIZER EASTMAN CHEMICAL COMPANY (US) 2020-12-30 WO claimed
US-20040208807-A1 Composition and process CYTEC TECHNOLOGY CORP. 2004-10-21 US claimed
US-20030147838-A1 Cosmetic films OPI PRODUCTS, INC. 2003-08-07 US claimed
US-20030124154-A1 Cosmetic films OPI PRODUCTS, INC. 2003-07-03 US claimed
US-RE37951-E1 Automotive additives and sealants containing waste powder prime HENKEL CORPORATION 2002-12-31 US claimed
EP-0673916-B1 Preparation of 2,2,4-trimethyl-1,3-pentanediol dibenzoate and di(alkyl-substituted) benzoates VELSICOL CHEMICAL CORP (US) 1998-01-07 EP claimed
EP-0416822-B1 Stain-resistant plasticizer compositions and method of making same VELSICOL CHEMICAL CORP (US) 1996-03-13 EP claimed
EP-0673916-A1 Preparation of 2,2,4-trimethyl-1,3-pentanediol dibenzoate and di(alkyl-substituted) benzoates VELSICOL CHEMICAL CORPORATION (US) 1995-09-27 EP claimed
US-5153342-A Esterification of 2,2,4-trimethyl-1,3-pentanediol with (alkyl) benzoic acids using basic catalysts HULS AMERICA INC. (US) 1992-10-06 US claimed
US-5039728-A Floor and wall coverings; vinly chloride homo- and copolymers HULS AMERICA INC. (US) 1991-08-13 US claimed
EP-0416822-A2 Stain-resistant plasticizer compositions and method of making same VELSICOL CHEMICAL CORPORATION (US) 1991-03-13 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12365785-B2 Glycol ether aryl ester plasticizer DAGLA, DDT, PPARG TRPA1 4212/4885DAO 2632/4885TSHR 2825/4885
US-20220227962-A1 GLYCOL ETHER ARYL ESTER PLASTICIZER DAGLA, DDT, PPARG TRPA1 4212/4885DAO 2632/4885TSHR 2825/4885
US-20260109795-A1 HIGH REFRACTIVE INDEX POLYVINYL ACETAL RESINS MODIFIED WITH CYCLIC ALDEHYDES TRIM4, TRIM58, TRA2B TRPA1 1153/4885DAO 3021/4885TSHR 3046/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.