Benzoic Acid

Benzoic Acid

SCHEMBL1000223

O=C(O)c1ccccc1.O=C(O)c1ccccc1.O=[SH2]=O

nearest known ligand 0.82

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 0.82
DAO P14920 1/20 0.82
NAPRT Q6XQN6 1/20 0.82
CES2 O00748 3/20 0.67
CES1 P23141 3/20 0.67
SRD5A2 P31213 2/20 0.67
TP53 P04637 1/20 0.61
ALDH1A1 P00352 1/20 0.55
TRPA1 O75762 1/20 0.52
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA6 P23280 3/20 0.50
CA9 Q16790 3/20 0.50
CA3 P07451 2/20 0.50
CA4 P22748 2/20 0.50
CA5A P35218 2/20 0.50
CA7 P43166 2/20 0.50
CA14 Q9ULX7 2/20 0.50
CA5B Q9Y2D0 2/20 0.50

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 SCHEMBL10528722 1.00 TSHR (0.82) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL10425703 0.97 TSHR (0.78) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL10529216 0.95 TSHR (0.74) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL407365 0.91 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL975929 0.91 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL976149 0.91 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL3966600 0.91 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL149318 0.91 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL7719037 0.91 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL137419 0.91 TSHR (1.00) 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 168 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546513-B2 Catalytic polymerization of polymers containing electrophiic linkages using nucleophilic reagents INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-10-01 US claimed
US-20130123458-A1 CATALYTIC POLYMERIZATION OF POLYMERS CONTAINING ELECTROPHIIC LINKAGES USING NUCLEOPHILIC REAGENTS THE BOARD OF DIRECTORS OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2013-05-16 US claimed
US-8367796-B2 Catalytic polymerization of polymers containing electrophilic linkages using nucleophilic reagents INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-02-05 US claimed
EP-3280537-B1 CENTRIFUGE COUNTERBALANCE WITH ADJUSTABLE CENTER OF GRAVITY AND METHODS FOR USING THE SAME ARTERIOCYTE MEDICAL SYSTEMS INC (US) 2024-07-17 EP disclosed
US-12038326-B2 Methods for spectrally resolving fluorophores of a sample and systems for same BECTON, DICKINSON AND COMPANY (US) 2024-07-16 US disclosed
EP-3785015-B1 FLOW CYTOMETERS HAVING ENCLOSED DROPLET SORTERS WITH CONTROLLED AEROSOL CONTENT AND METHODS OF USING THE SAME BECTON DICKINSON CO (US) 2024-06-26 EP disclosed
WO-2024129707-A1 REAL-TIME ADAPTIVE METHODS FOR SPECTRALLY RESOLVING FLUOROPHORES OF A SAMPLE AND SYSTEMS FOR SAME BECTON, DICKINSON AND COMPANY (US) 2024-06-20 WO disclosed
US-20240192122-A1 REAL-TIME ADAPTIVE METHODS FOR SPECTRALLY RESOLVING FLUOROPHORES OF A SAMPLE AND SYSTEMS FOR SAME BECTON, DICKINSON AND COMPANY 2024-06-13 US disclosed
US-11988589-B2 Parameters for use in particle discrimination BECTON, DICKINSON AND COMPANY (US) 2024-05-21 US disclosed
US-11978269-B2 Reconfigurable integrated circuits for adjusting cell sorting classification BECTON, DICKINSON AND COMPANY (US) 2024-05-07 US disclosed
US-11971343-B2 Dual excitation beams for irradiating a sample in a flow stream and methods for using same BECTON, DICKINSON AND COMPANY (US) 2024-04-30 US disclosed
US-5773144-A FIBERS, FILAMENTS USEFUL FOR RUBBER REINFORCEMENT, ESPECIALLY TIRES HOECHST CELANESE CORP. (US) 1998-06-30 US disclosed
WO-1998008619-A1 METHOD FOR MELT-COATING SURFACES WITH CURABLE POWDER POLYMER COMPOSITIONS HOECHST CELANESE CORPORATION (US) 1998-03-05 WO disclosed
US-5654097-A POLYESTER, POLYAMIDE CORE, THERMOPLASTIC SHEATH; TIRE REINFORCEMENT HOECHST CELANESE CORP. (US) 1997-08-05 US disclosed
US-5624754-A MULTICOMPONENT FILAMENTS COMPRISING POLYESTER CORE AND A SHEATH OF A COMPATIBLE THERMOPLASTIC ELASTOMER BLENDS HOECHST CELANESE CORP. (US) 1997-04-29 US disclosed
US-5597651-A Rubber-polyester composites including polystyrene-polyester copolymers HOECHST CELANESE CORP. (US) 1997-01-28 US disclosed
EP-0154985-A2 Organosilicon/oxirane additives for filled condensation polymer composites UNION CARBIDE CORPORATION (US) 1985-09-18 EP disclosed
US-4542174-A NONHYDROLYZING, STORAGE STABLE UNION CARBIDE CORPORATION (US) 1985-09-17 US disclosed
US-3995091-A Wire coated with a fluorocarbon polymer cross-linked with esters of sulfonyl dibenzoic acid INTERNATIONAL TELEPHONE AND TELEGRAPH CORPORATION (US) 1976-11-30 US disclosed
US-3985716-A POLYMER-CROSSLINKING CATALYST INTERNATIONAL TELEPHONE AND TELEGRAPH CORPORATION (US) 1976-10-12 US disclosed