Benzoic Acid

Benzoic Acid

SCHEMBL1716154

C1CCCNCC1.O=C(O)c1ccccc1

nearest known ligand 0.61

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
TSHR P16473 3/20 0.61
DAO P14920 1/20 0.61
NAPRT Q6XQN6 1/20 0.61
CES2 O00748 2/20 0.52
CES1 P23141 2/20 0.52
SRD5A2 P31213 2/20 0.52
SIGMAR1 Q99720 1/20 0.50
CYP2C8 P10632 1/20 0.50
CYP2C9 P11712 1/20 0.50
OPRD1 P41143 1/20 0.49
TP53 P04637 1/20 0.46
ALDH1A1 P00352 2/20 0.44
USP2 O75604 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 1/20 0.42
TRPA1 O75762 1/20 0.42
KMO O15229 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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 SCHEMBL1249244 1.00 TSHR (0.61) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL1088757 0.98 TSHR (0.58) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL2492854 0.98 TSHR (0.64) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL5272746 0.94 TSHR (0.54) TSHRDAONAPRTCES2CES1
Terephthalic Acid SCHEMBL28988329 0.91 TSHR (0.57) TSHRDAONAPRTCES2CES1
Terephthalic Acid SCHEMBL9063579 0.91 TSHR (0.57) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL28890058 0.91 TSHR (0.74) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL8503046 0.89 TSHR (0.58) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL8502658 0.89 TSHR (0.58) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL29078253 0.89 TSHR (0.58) TSHRDAONAPRTCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8450931-B2 Process for minimizing electromigration in an electronic device DOW CORNING CORPORATION (US) 2013-05-28 US claimed
EP-1880416-B1 PROCESS FOR MINIMIZING ELECTROMIGRATION IN AN ELECTRONIC DEVICE DOW CORNING (US) 2012-01-18 EP claimed
JP-4602970-B2 2010-12-22 JP claimed
EP-1597332-B1 CONDUCTIVE ADHESIVE COMPOSITIONS WITH ELECTRICAL STABILITY AND GOOD IMPACT RESISTANCE FOR USE IN ELECTRONICS DEVICES NAT STARCH CHEM INVEST (US) 2008-05-07 EP claimed
US-20080054806-A1 Process for Minimizing Electromigration in an Electronic Device DOW CORNING CORPORATION 2008-03-06 US claimed
EP-1880416-A1 PROCESS FOR MINIMIZING ELECTROMIGRATION IN AN ELECTRONIC DEVICE Dow Corning Corporation (US) 2008-01-23 EP claimed
WO-2006122025-A1 PROCESS FOR MINIMIZING ELECTROMIGRATION IN AN ELECTRONIC DEVICE DOW CORNING CORPORATION (US) 2006-11-16 WO claimed
US-7108806-B2 Mixing epoxy resin, amine, filler, corrosion inhibitor and oxygen scavenger, imidazole curing agent and solvent NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2006-09-19 US claimed
EP-1597332-A1 CONDUCTIVE ADHESIVE COMPOSITIONS WITH ELECTRICAL STABILITY AND GOOD IMPACT RESISTANCE FOR USE IN ELECTRONICS DEVICES National Starch and Chemical Investment Holding Corporation (US) 2005-11-23 EP claimed
WO-2004078870-A1 CONDUCTIVE ADHESIVE COMPOSITIONS WITH ELECTICAL STABILITY AND GOOD IMPACT RESISTANCE FOR USE IN ELECTRONICS DEVICES NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2004-09-16 WO claimed
US-20040169162-A1 Conductive materials with electrical stability and good impact resistance for use in electronics devices HENKEL AG & CO. KGAA (DE) 2004-09-02 US claimed
EP-1032038-A2 Conductive and resitive material with electrical stability for use in electronics devices National Starch and Chemical Investment Holding Corporation (US) 2000-08-30 EP claimed
US-4051066-A Corrosion-inhibiting rubber and methods of preparation NORTHERN INSTRUMENTS CORPORATION (US) 1977-09-27 US claimed
CN-107001216-B Intermediates and methods for preparing sandalwood oil building blocks 弗门尼舍有限公司 2020-12-01 CN disclosed
EP-3227255-B1 INTERMEDIATES AND PROCESS FOR THE PREPARATION OF SANDALWOOD OIL BUILDING BLOCKS FIRMENICH & CIE (CH) 2018-11-07 EP disclosed
US-9879203-B2 Intermediates and process for the preparation of sandalwood oil building blocks FIRMENICH SA (CH) 2018-01-30 US disclosed
US-4451462-A Method of treating inflammation and pain using heteramino benzofurans CIBA-GEIGY CORPORATION (US) 1984-05-29 US disclosed
US-4426380-A ANTIINFLAMMATORY, ANALGESIC, SUNSCREEN CIBA-GEIGY CORPORATION (US) 1984-01-17 US disclosed
EP-0078241-A2 Furanes CIBA-GEIGY AG (CH) 1983-05-04 EP disclosed
US-4051066-A Corrosion-inhibiting rubber and methods of preparation NORTHERN INSTRUMENTS CORPORATION (US) 1977-09-27 US disclosed