Benzoic Acid

Benzoic Acid

SCHEMBL8917895

COc1ccccc1-c1ccccc1.O=C(O)c1ccccc1

nearest known ligand 0.58

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
RXRA P19793 2/20 0.58
RXRB P28702 1/20 0.58
RXRG P48443 1/20 0.58
TDP1 Q9NUW8 4/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
FABP3 P05413 1/20 0.54
EGLN1 Q9GZT9 1/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
HSD17B10 Q99714 1/20 0.53
LMNA P02545 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
EGFR P00533 1/20 0.51
DHODH Q02127 1/20 0.51
KAT6A Q92794 1/20 0.51
DAO P14920 1/20 0.50
TSHR P16473 1/20 0.50
NAPRT Q6XQN6 1/20 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
SCHEMBL1222758 0.93 RXRA (0.58) RXRARXRBRXRGTDP1EGLN1
SCHEMBL417159 0.88 KAT6A (0.61) TDP1L3MBTL1LMNAMAPK1HTT
SCHEMBL17799599 0.87 KAT6A (0.63) TDP1L3MBTL1LMNAMAPK1HTT
Methyl Alcohol SCHEMBL28372647 0.85 ALDH1A1 (0.55) TDP1L3MBTL1FABP3KDM4EALDH1A1
SCHEMBL294721 0.84 ALDH1A1 (0.58) L3MBTL1FABP3KDM4EALDH1A1LMNA
SCHEMBL30136447 0.84 ALDH1A1 (0.58) L3MBTL1FABP3KDM4EALDH1A1LMNA
SCHEMBL3647093 0.84 EGLN1 (0.52) TDP1EGLN1KDM4EALDH1A1HPGD
SCHEMBL5924712 0.84 EGLN1 (0.52) TDP1EGLN1KDM4EALDH1A1HPGD
SCHEMBL27847027 0.84 ATM (0.56) TDP1L3MBTL1EGLN1KDM4EALDH1A1
SCHEMBL30017788 0.82 ALDH1A1 (0.56) L3MBTL1FABP3KDM4EALDH1A1LMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5644416-A LIQUID CRYSTAL POLYMER FILM FUJI XEROX CO., LTD. (JP) 1997-07-01 US disclosed
EP-0395006-B1 Display composition, coloring pigment, and recording material SONY CORP (JP) 1994-08-31 EP disclosed
US-5179065-A Recording material with a display composition including a coloring pigment SONY CORPORATION (JP) 1993-01-12 US disclosed
US-5160371-A Leuco dye and quaternized clay SONY CORPORATION (JP) 1992-11-03 US disclosed
EP-0294724-B1 DISPLAY MATERIAL SONY CORPORATION (JP) 1992-05-20 EP disclosed
US-4957352-A Electrochromic display device SONY CORPORATION (JP) 1990-09-18 US disclosed
US-4940689-A Display material SONY CORPORATION (JP) 1990-07-10 US disclosed
EP-0301513-A2 Electrochromic display SONY CORPORATION (JP) 1989-02-01 EP disclosed
EP-0294724-A2 Display material SONY CORPORATION (JP) 1988-12-14 EP disclosed