Benzoic Acid

Benzoic Acid

SCHEMBL2239809

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

nearest known ligand 0.65

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
MAPK1 P28482 1/20 0.65
HIF1A Q16665 1/20 0.65
TDP1 Q9NUW8 4/20 0.56
SLC6A3 Q01959 2/20 0.56
HTR1A P08908 1/20 0.56
CYP2D6 P10635 1/20 0.56
SCN1A P35498 1/20 0.56
SCN5A Q14524 1/20 0.56
SCN2A Q99250 1/20 0.56
SCN3A Q9NY46 1/20 0.56
LMNA P02545 2/20 0.53
ALDH1A1 P00352 3/20 0.52
KMT2A Q03164 2/20 0.52
TSHR P16473 4/20 0.50
DAO P14920 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
SLC6A2 P23975 1/20 0.50
ADRB2 P07550 1/20 0.49
ADRB1 P08588 1/20 0.49
ADRB3 P13945 1/20 0.49

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
SCHEMBL444012 0.94 MAPK1 (0.71) MAPK1HIF1ATDP1SLC6A3HTR1A
SCHEMBL3453675 0.93 MAPK1 (0.53) MAPK1HIF1ATDP1SLC6A3HTR1A
Terephthalic Acid SCHEMBL2442144 0.93 MAPK1 (0.53) MAPK1HIF1ATDP1SLC6A3HTR1A
Ethylene Glycol SCHEMBL226247 0.89 MAPK1 (0.65) MAPK1HIF1ATDP1SLC6A3HTR1A
Ethylene Glycol SCHEMBL28877079 0.88 MAPT (0.49) MAPK1HIF1ATDP1SLC6A3HTR1A
SCHEMBL9988314 0.86 MAPK1 (0.51) MAPK1HIF1ATDP1SLC6A3HTR1A
SCHEMBL3669896 0.85 MAPK1 (0.55) MAPK1HIF1ATDP1SLC6A3HTR1A
SCHEMBL204567 0.83 MAPK1 (0.71) MAPK1HIF1ATDP1SLC6A3HTR1A
SCHEMBL2020359 0.83 MAPK1 (0.71) MAPK1HIF1ATDP1SLC6A3HTR1A
Benzoic Acid SCHEMBL21834840 0.82 MAPK1 (0.70) MAPK1HIF1ATDP1SLC6A3HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023137146-A9 CELLULOSE ESTER COMPOSITION AND PROCESS FOR PRODUCING ARTICLES THEREFROM CELANESE INTERNATIONAL CORPORATION (US) 2024-05-23 WO claimed
US-20240026130-A1 Bio-Based Polymer Composition Containing Odor Masking Agent CELANESE INT CORP (US) 2024-01-25 US claimed
WO-2024020195-A1 COMPOSITION CONTAINING CELLULOSE ESTER POLYMER WITH ENHANCED MELT STRENGTH AGENT CELANESE INTERNATIONAL CORPORATION (US) 2024-01-25 WO claimed
WO-2024020193-A1 BIO-BASED POLYMER COMPOSITION CONTAINING ODOR MASKING AGENT CELANESE INTERNATIONAL CORPORATION (US) 2024-01-25 WO claimed
US-20240026122-A1 Composition Containing Cellulose Ester Polymer With Enhanced Melt Strength Agent CELANESE INTERNATIONAL CORPORATION 2024-01-25 US claimed
WO-2023244729-A1 CELLULOSE ESTER POLYMER PRODUCT WITH INCREASED MELT FLOW PROPERTIES AND REFLECTANCE CELANESE INTERNATIONAL CORPORATION (US) 2023-12-21 WO claimed
EP-4258858-A1 FOAM FORMED FROM CELLULOSE ESTER COMPOSITION Celanese International Corporation (US) 2023-10-18 EP claimed
CN-116867362-A Foams formed from cellulose ester compositions 国际人造丝公司 2023-10-10 CN claimed
EP-4247606-A1 CELLULOSE ESTER COMPOSITION AND ARTICLES MADE THEREFROM Celanese International Corporation (US) 2023-09-27 EP claimed
WO-2023172722-A1 CELLULOSE ESTER POLYMER COMPOSITION AND MOLDED ARTICLES MADE THEREFROM CELANESE INTERNATIONAL CORPORATION (US) 2023-09-14 WO claimed
US-20230226735-A1 Process and System For Blending A Plasticizer With A Polysaccharide Ester Polymer CELANESE INTERNATIONAL CORPORATION 2023-07-20 US claimed
US-20230226734-A1 Cellulose Ester Composition and Process For Producing Articles Therefrom CELANESE INT CORP (US) 2023-07-20 US claimed
WO-2023137146-A1 CELLULOSE ESTER COMPOSITION AND PROCESS FOR PRODUCING ARTICLES THEREFROM CELANESE INTERNATIONAL CORPORATION (US) 2023-07-20 WO claimed
WO-2023096882-A1 BIODEGRADABLE COMPOSITE ARTICLE CELANESE INTERNATIONAL CORPORATION (US) 2023-06-01 WO claimed
WO-2022125916-A1 FOAM FORMED FROM CELLULOSE ESTER COMPOSITION CELANESE INTERNATIONAL CORPORATION (US) 2022-06-16 WO claimed
US-20220185978-A1 Foam Formed From Cellulose Ester Composition CELANESE INT CORP (US) 2022-06-16 US claimed
WO-2022109228-A1 CELLULOSE ESTER COMPOSITION AND ARTICLES MADE THEREFROM CELANESE INTERNATIONAL CORPORATION (US) 2022-05-27 WO claimed
US-4368285-A MOLDING MATERIALS DART INDUSTRIES INC. (US) 1983-01-11 US claimed
US-4340526-A ESTER PLASTICIZERS TO LOWER THE MELT VISCOSITY EASTMAN KODAK COMPANY (US) 1982-07-20 US claimed
US-4172824-A PLASTICIZER EASTMAN KODAK COMPANY (US) 1979-10-30 US claimed