Benzoic Acid

Benzoic Acid

SCHEMBL532786

O=C(O)c1ccccc1.O=C(O)c1ccccc1.OCC1CCC(CO)CC1

nearest known ligand 0.58

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 2/20 0.58
DAO P14920 1/20 0.58
NAPRT Q6XQN6 1/20 0.58
CES1 P23141 3/20 0.50
CES2 O00748 2/20 0.50
SRD5A2 P31213 1/20 0.50
CYP2C9 P11712 2/20 0.44
CYP2C8 P10632 1/20 0.44
TP53 P04637 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP3A4 P08684 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PKM P14618 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 SCHEMBL17797781 1.00 TSHR (0.58) TSHRDAONAPRTCES1CES2
Terephthalic Acid SCHEMBL31485057 0.91 TSHR (0.55) TSHRDAONAPRTCES1CES2
Terephthalic Acid SCHEMBL87786 0.91 TSHR (0.55) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL3262300 0.90 DAO (0.52) TSHRDAONAPRTCES1CES2
Terephthalic Acid SCHEMBL9862718 0.89 KMO (0.47) TSHRDAONAPRTCES1CES2
Isophthalic Acid SCHEMBL17628646 0.88 KMO (0.50) TSHRDAONAPRTCYP2C9MEN1
Terephthalic Acid SCHEMBL28820897 0.88 TSHR (0.50) TSHRDAONAPRTCES1CES2
Terephthalic Acid SCHEMBL2206532 0.88 TSHR (0.50) TSHRDAONAPRTCES1CES2
Terephthalic Acid SCHEMBL27707378 0.88 TSHR (0.50) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL7604226 0.85 DAO (0.50) TSHRDAONAPRTCES1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3860863-B1 METHOD FOR CREATING A SECURITY ELEMENT ON SECURITY DOCUMENTS AND SECURITY DOCUMENT CONTAINING SECURITY ELEMENT ANY BIZTONSAGI NYOMDA NYRT (HU) 2024-08-21 EP claimed
CN-112639044-A Compostable hot melt adhesive 波士胶公司 2021-04-09 CN claimed
US-9587086-B2 Poly(vinyl acetal) resin compositions, layers, and interlayers having enhanced optical properties EASTMAN CHEMICAL COMPANY (US) 2017-03-07 US claimed
US-20160160005-A1 POLY(VINYL ACETAL) RESIN COMPOSITIONS, LAYERS, AND INTERLAYERS HAVING ENHANCED OPTICAL PROPERTIES SOLUTION INC. (US) 2016-06-09 US claimed
US-9200137-B2 Compositions comprising structural isomers of 1,4-cyclohexanedimethanol dibenzoate and polymer compositions containing same EASTMAN SPECIALTIES HOLDINGS CORPORATION (US) 2015-12-01 US claimed
EP-2694609-B1 POLYOLEFIN BASED HOT MELT ADHESIVE CONTAINING A SOLID PLASTICIZER BOSTIK INC (US) 2015-08-19 EP claimed
EP-2709982-B1 POWDERY PEROXIDE COMPOSITIONS ACCEPTABLE FOR OCCUPATIONAL HEALTH PERGAN GmbH (DE) 2015-02-18 EP claimed
US-20130237939-A1 NOVEL COMPOSITIONS COMPRISING STRUCTURAL ISOMERS OF 1,4-CYCLOHEXANEDIMETHANOL DIBENZOATE AND POLYMER COMPOSITIONS CONTAINING SAME EASTMAN SPECIALTIES HOLDINGS CORPORATION (US) 2013-09-12 US claimed
US-8431232-B2 Aromatic-aliphatic polyester hot melt adhesives for roll-applied labels EASTMAN CHEMICAL COMPANY (US) 2013-04-30 US claimed
US-8389117-B2 Hot melt adhesives for roll-applied labels EASTMAN CHEMICAL COMPANY (US) 2013-03-05 US claimed
EP-2222460-A1 NOVEL COMPOSITIONS COMPRISING STRUCTURAL ISOMERS OF 1,4-CYCLOHEXANEDIMETHANOL DIBENZOATE AND POLYMER COMPOSITIONS CONTAINING SAME Genovique Specialties Holdings Corporation (US) 2010-09-01 EP claimed
WO-2010056271-A1 AROMATIC-ALIPHATIC POLYESTER HOT MELT ADHESIVES FOR ROLL-APPLIED LABELS EASTMAN CHEMICAL COMPANY (US) 2010-05-20 WO claimed
WO-2010056270-A1 HOT MELT ADHESIVES FOR ROLL-APPLIED LABELS EASTMAN CHEMICAL COMPANY (US) 2010-05-20 WO claimed
US-20100112251-A1 AROMATIC-ALIPHATIC POLYESTER HOT MELT ADHESIVES FOR ROLL-APPLIED LABELS EASTMAN CHEMICAL COMPANY (US) 2010-05-06 US claimed
US-20100112250-A1 HOT MELT ADHESIVES FOR ROLL-APPLIED LABELS EASTMAN CHEMICAL COMPANY (US) 2010-05-06 US claimed
WO-2009073393-A1 NOVEL COMPOSITIONS COMPRISING STRUCTURAL ISOMERS OF 1,4-CYCLOHEXANEDIMETHANOL DIBENZOATE AND POLYMER COMPOSITIONS CONTAINING SAME GENOVIQUE SPECIALTIES HOLDINGS CORPORATION (US) 2009-06-11 WO claimed
US-20090142981-A1 Novel Compositions Comprising Structural Isomers Of 1,4-Cyclohexanedimethanol Dibenzoate and Polymer Compositions Containing Same VELSICOL CHEMICAL CORPORATION (US) 2009-06-04 US claimed
EP-1629988-B1 Fusible inkjet media including solid plasticizer particles and methods of forming and using the fusible inkjet media HEWLETT PACKARD DEVELOPMENT CO (US) 2008-12-24 EP claimed
EP-1629988-A2 Fusible inkjet media including solid plasticizer particles and methods of forming and using the fusible inkjet media Hewlett-Packard Development Company, L.P. (US) 2006-03-01 EP claimed
US-20060038871-A1 Fusible inkjet media including solid plasticizer particles and methods of forming and using the fusible inkjet media HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2006-02-23 US claimed