Benzoic Acid

Benzoic Acid

SCHEMBL1786954

CCCC(O)C(C)(C)C(O)CCC.O=C(O)c1ccccc1.O=C(O)c1ccccc1

nearest known ligand 0.48

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
DAO P14920 1/20 0.48
TSHR P16473 1/20 0.48
NAPRT Q6XQN6 1/20 0.48
PRSS1 P07477 4/20 0.44
CTSG P08311 4/20 0.44
CTRB1 P17538 4/20 0.44
CMA1 P23946 4/20 0.44
CES2 O00748 5/20 0.42
CES1 P23141 5/20 0.42
SRD5A2 P31213 1/20 0.42
SLC6A3 Q01959 2/20 0.42
SLC6A2 P23975 1/20 0.42
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.38
HTR1A P08908 1/20 0.38
CYP2D6 P10635 1/20 0.38
SCN1A P35498 1/20 0.38

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 SCHEMBL1784704 0.95 TSHR (0.44) DAOTSHRNAPRTPRSS1CTSG
Benzoic Acid SCHEMBL28045356 0.92 DAO (0.44) DAOTSHRNAPRTPRSS1CTSG
Benzoic Acid SCHEMBL1784532 0.88 TSHR (0.47) DAOTSHRNAPRTPRSS1CTSG
Benzoic Acid SCHEMBL1070689 0.86 TSHR (0.52) DAOTSHRNAPRTPRSS1CTSG
SCHEMBL17699366 0.85 SRD5A2 (0.57) SRD5A2KMT2ATDP1
Benzoic Acid SCHEMBL27642058 0.85 TSHR (0.44) DAOTSHRNAPRTPRSS1CTSG
Benzoic Acid SCHEMBL1789329 0.85 DAO (0.47) DAOTSHRNAPRTPRSS1CTSG
Benzoic Acid SCHEMBL28604331 0.84 TSHR (0.42) DAOTSHRNAPRTPRSS1CTSG
Benzoic Acid SCHEMBL1784796 0.83 DAO (0.45) DAOTSHRNAPRTPRSS1CTSG
Benzoic Acid SCHEMBL1783514 0.83 TSHR (0.41) DAOTSHRNAPRTPRSS1CTSG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1472293-B1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFINS, CATALYST COMPRISING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2017-04-26 EP claimed
US-7388061-B2 Solid catalyst component for polymerization of olefins, catalyst comprising the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-06-17 US claimed
US-20050239636-A1 Solid catalyst component for polymerization of olefins, catalyst comprising the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2005-10-27 US claimed
CN-117801140-A Catalyst system for olefin polymerization reaction, prepolymerized catalyst composition and application 中国石油化工股份有限公司 2024-04-02 CN disclosed
CN-117801139-A Catalyst system for olefin polymerization reaction, prepolymerized catalyst composition and application 中国石油化工股份有限公司 2024-04-02 CN disclosed
CN-114426599-B Catalyst component for preparing polyolefin, preparation method thereof, olefin polymerization catalyst and application thereof 中国石油化工股份有限公司 2023-11-10 CN disclosed
CN-112300304-B Catalyst system for olefin polymerization and prepolymerized catalyst composition 中国石油化工股份有限公司 2023-08-15 CN disclosed
CN-112300303-B Catalyst system for olefin polymerization and application thereof 中国石油化工股份有限公司 2023-08-15 CN disclosed
CN-114456286-B Catalyst system for olefin polymerization and application thereof 中国石油化工股份有限公司 2023-08-15 CN disclosed
CN-114456290-B Catalyst system for olefin polymerization and prepolymerized catalyst composition 中国石油化工股份有限公司 2023-07-21 CN disclosed
CN-112300302-B Twelve-membered ring compound and application thereof 中国石油化工股份有限公司 2023-05-09 CN disclosed
EP-1666505-A1 CATALYST COMPONENTS CATALYSTS FOR OLEFINIC POLYMERIZATION AND THE USE THEREOF China Petroleum & Chemical Corporation (CN) 2006-06-07 EP disclosed
CN-1743348-A Catalyst component for olefinic polymerization and its catalyst CHINA PETROCHEMICAL CORP (CN) 2006-03-08 CN disclosed
CN-1743346-A Catalyst component for olefinic polymerization and its catalyst CHINA PETROCHEMICAL CORP (CN) 2006-03-08 CN disclosed
US-20050239636-A1 Solid catalyst component for polymerization of olefins, catalyst comprising the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2005-10-27 US disclosed
CN-1218234-C Free form code Chinese input method LIANG CHUANREN (CN) 2005-09-07 CN disclosed
CN-1213080-C Catalyst for olefine polymerizing reaction and its components CHINA PETROCHEMICAL CORP (CN) 2005-08-03 CN disclosed
US-20050119427-A1 Catalyst component and catalyst for olefin polymerization as well as use thereof BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2005-06-02 US disclosed
CN-1453298-A Catalyst for olefine polymerizing reaction and its components CHINA PETROCHEMICAL CORP (CN) 2003-11-05 CN disclosed
CN-1436237-A Nucleotide sequences involved in increasing or decreasing ovulation rate in mammals AGRES LTD (NZ) 2003-08-13 CN disclosed