Benzoic Acid

Benzoic Acid

SCHEMBL569618

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

nearest known ligand 0.50

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
DAO P14920 1/20 0.50
TSHR P16473 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
MAPK1 P28482 3/20 0.47
CES1 P23141 2/20 0.44
CES2 O00748 1/20 0.44
SRD5A2 P31213 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
MAPT P10636 4/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
KDM4E B2RXH2 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
HSD17B10 Q99714 1/20 0.43
RARB P10826 1/20 0.42
POLB P06746 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
TAS2R14 Q9NYV8 1/20 0.41
HPGD P15428 2/20 0.41
MEN1 O00255 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 SCHEMBL27523987 0.96 DAO (0.50) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL27505395 0.89 DAO (0.42) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL27592493 0.89 DAO (0.42) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL247596 0.89 TSHR (0.64) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL27523764 0.88 TSHR (0.41) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL570135 0.86 DAO (0.50) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL28673610 0.85 TSHR (0.54) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL571293 0.84 TSHR (0.52) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL27585521 0.84 TSHR (0.52) DAOTSHRNAPRTMAPK1CES1
Benzoic Acid SCHEMBL570498 0.83 TSHR (0.47) DAOTSHRNAPRTCES1CES2

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 36 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-2601223-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2013-06-12 EP disclosed
CN-103154049-A Process for preparing high purity propylene polymers BASELL POLIOLEFINE SRL 2013-06-12 CN disclosed
US-20130131293-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2013-05-23 US disclosed
US-20130131290-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-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-2012052386-A1 PROCESS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2012-04-26 WO disclosed
WO-2012017038-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2012-02-09 WO disclosed