Benzoic Acid

Benzoic Acid

SCHEMBL595707

CCO.N.O=C(O)c1ccccc1

nearest known ligand 0.70

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 0.70
DAO P14920 1/20 0.70
NAPRT Q6XQN6 1/20 0.70
CES1 P23141 7/20 0.58
CES2 O00748 6/20 0.58
SRD5A2 P31213 2/20 0.58
ALDH1A1 P00352 3/20 0.54
TP53 P04637 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PKM P14618 1/20 0.47
LMNA P02545 1/20 0.47

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 SCHEMBL30648522 0.97 TSHR (0.74) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL3948196 0.97 TSHR (0.74) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL28761872 0.97 TSHR (0.74) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL11583366 0.95 TSHR (0.70) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL11785134 0.91 TSHR (0.64) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL9861287 0.90 TSHR (0.70) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL28693411 0.90 TSHR (0.78) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL28601772 0.90 TSHR (0.78) TSHRDAONAPRTCES1CES2
Terephthalic Acid SCHEMBL11804308 0.90 TSHR (0.67) TSHRDAONAPRTCES1CES2
Benzoic Acid SCHEMBL2400344 0.90 TSHR (0.78) 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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160362560-A1 USE OF CHARGED CELLULOSE NANOCRYSTALS FOR CORROSION INHIBITION AND A CORROSION INHIBITING COMPOSITION COMPRISING THE SAME NANOHIBITOR TECHNOLOGY INC. (CA) 2016-12-15 US claimed
US-9359678-B2 Use of charged cellulose nanocrystals for corrosion inhibition and a corrosion inhibiting composition comprising the same NANOHIBITOR TECHNOLOGY INC. (CA) 2016-06-07 US claimed
US-20160102409-A1 USE OF CHARGED CELLULOSE NANOCRYSTALS FOR CORROSION INHIBITION AND A CORROSION INHIBITING COMPOSITION COMPRISING THE SAME NANOHIBITOR TECHNOLOGY INC. (CA) 2016-04-14 US claimed
WO-2015000063-A1 USE OF CHARGED CELLULOSE NANOCRYSTALS FOR CORROSION INHIBITION AND A CORROSION INHIBITING COMPOSITION COMPRISING THE SAME NANOBLOC TECHNOLOGY INC. (CA) 2015-01-08 WO claimed
US-8116036-B2 Corrosion inhibitor incorporated in carbon overcoats SEAGATE TECHNOLOGY LLC (US) 2012-02-14 US claimed
US-20110014497-A1 CORROSION INHIBITOR INCORPORATED IN CARBON OVERCOATS SEAGATE TECHNOLOGY LLC (US) 2011-01-20 US claimed
EP-1954879-A2 AN ANTICORROSIVE PAPER OR PAPERBOARD MATERIAL INTERNATIONAL PAPER COMPANY (US) 2008-08-13 EP claimed
WO-2007053597-A2 AN ANTICORROSIVE PAPER OR PAPERBOARD MATERIAL INTERNATIONAL PAPER COMPANY (US) 2007-05-10 WO claimed
US-20070098932-A1 Anticorrosive paper or paperboard material INTERNATIONAL PAPER COMPANY 2007-05-03 US claimed
US-20160362560-A1 USE OF CHARGED CELLULOSE NANOCRYSTALS FOR CORROSION INHIBITION AND A CORROSION INHIBITING COMPOSITION COMPRISING THE SAME NANOHIBITOR TECHNOLOGY INC. (CA) 2016-12-15 US disclosed
US-9359678-B2 Use of charged cellulose nanocrystals for corrosion inhibition and a corrosion inhibiting composition comprising the same NANOHIBITOR TECHNOLOGY INC. (CA) 2016-06-07 US disclosed
US-20160102409-A1 USE OF CHARGED CELLULOSE NANOCRYSTALS FOR CORROSION INHIBITION AND A CORROSION INHIBITING COMPOSITION COMPRISING THE SAME NANOHIBITOR TECHNOLOGY INC. (CA) 2016-04-14 US disclosed
WO-2015000063-A1 USE OF CHARGED CELLULOSE NANOCRYSTALS FOR CORROSION INHIBITION AND A CORROSION INHIBITING COMPOSITION COMPRISING THE SAME NANOBLOC TECHNOLOGY INC. (CA) 2015-01-08 WO disclosed
US-8116036-B2 Corrosion inhibitor incorporated in carbon overcoats SEAGATE TECHNOLOGY LLC (US) 2012-02-14 US disclosed
US-20070098932-A1 Anticorrosive paper or paperboard material INTERNATIONAL PAPER COMPANY 2007-05-03 US disclosed
EP-0990676-B1 Biodegradable vapor corrosion inhibitor products CORTEC CORP (US) 2006-05-31 EP disclosed
EP-1116746-A2 Biodegradable film CORTEC CORPORATION (US) 2001-07-18 EP disclosed
US-6156929-A Biodegradable film CORTEC CORPORATION (US) 2000-12-05 US disclosed
EP-0990676-A1 Biodegradable vapor corrosion inhibitor products CORTEC CORPORATION (US) 2000-04-05 EP disclosed
US-6028160-A A BLENDS CONSISTING OF POLYETHYLENE, STARCH, POLYLACTIC ACID OR POLYCAPROLACTONE, AND A POLYESTER COPOLYMER OF BUTANEDIOL, ADIPIC ACID, SUCCINIC ACID, AND TEREPHTHALIC ACID; BULK FILLER PACKING FORMS FOR PACKAGING APPLICATIONS CORTEC CORPORATION (US) 2000-02-22 US disclosed