Benzoic Acid

Benzoic Acid

SCHEMBL569416

CC(C)CC(O)CC(O)CC(C)C.O=C(O)c1ccccc1.O=C(O)c1ccccc1

nearest known ligand 0.54

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 0.54
DAO P14920 1/20 0.54
NAPRT Q6XQN6 1/20 0.54
CES2 O00748 2/20 0.47
CES1 P23141 2/20 0.47
SRD5A2 P31213 1/20 0.47
LMNA P02545 2/20 0.42
MAPK1 P28482 1/20 0.42
CYP2C8 P10632 1/20 0.42
CYP2C9 P11712 1/20 0.42
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
FOLH1 Q04609 1/20 0.41
PTGER4 P35408 1/20 0.41
PTGER2 P43116 1/20 0.41
CTSL P07711 2/20 0.41
CTSB P07858 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 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 SCHEMBL27522251 0.93 DAO (0.47) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL14690382 0.93 DAO (0.50) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL569521 0.93 DAO (0.50) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL14689955 0.93 DAO (0.50) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL28366021 0.90 DAO (0.44) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL29050202 0.86 DAO (0.47) TSHRDAONAPRTCES2CES1
Benzoyl Formic Acid SCHEMBL16044745 0.85 CES2 (0.46) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL569450 0.85 DAO (0.50) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL28997523 0.84 ALDH1A1 (0.38) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL571293 0.83 TSHR (0.52) 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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3397658-B1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS BRASKEM AMERICA INC (US) 2022-07-27 EP disclosed
US-11117982-B2 Non-phthalate catalyst system and its use in the polymerization of olefins BRASKEM AMERICA, INC. (US) 2021-09-14 US disclosed
US-11041028-B2 Non-phthalate catalyst system and its use in the polymerization of olefins BRASKEM AMERICA, INC. (US) 2021-06-22 US disclosed
US-20200199262-A1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS BRASKEM AMERICA, INC. 2020-06-25 US disclosed
US-10633464-B2 Non-phthalate catalyst system and its use in the polymerization of olefins BRASKEM AMERICA, INC. (US) 2020-04-28 US disclosed
US-10633463-B2 Non-phthalate catalyst system and its use in the polymerization of olefins BRASKEM AMERICA, INC. (US) 2020-04-28 US disclosed
US-20190016832-A1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS BRASKEM AMERICA, INC. (US) 2019-01-17 US disclosed
US-20190010258-A1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS BRASKEM AMERICA, INC. 2019-01-10 US disclosed
US-20190010264-A1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS BRASKEM AMERICA, INC. 2019-01-10 US disclosed
EP-3397659-A1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS Braskem America, Inc. (US) 2018-11-07 EP disclosed
EP-2601224-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2013-06-12 EP disclosed
US-20130131290-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia, s.r.l. (IT) 2013-05-23 US disclosed
US-20130131293-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2013-05-23 US disclosed
CN-103052658-A Catalyst components for the polymerization of olefins BASELL POLIOLEFINE SRL 2013-04-17 CN disclosed
CN-103052659-A Catalyst components for the polymerization of olefins BASELL POLIOLEFINE SRL 2013-04-17 CN disclosed
WO-2012052386-A1 PROCESS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2012-04-26 WO disclosed
WO-2012052387-A1 CATALYST SYSTEM FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2012-04-26 WO disclosed
WO-2012052389-A1 PROCESS FOR THE PREPARATION OF HIGH PURITY PROPYLENE POLYMERS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2012-04-26 WO disclosed
WO-2012017040-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2012-02-09 WO disclosed
WO-2012017038-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2012-02-09 WO disclosed