Benzoic Acid

Benzoic Acid

SCHEMBL3313836

O=C(O)c1ccccc1.c1cncnc1

nearest known ligand 0.67

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
NAPRT Q6XQN6 2/20 0.67
TSHR P16473 2/20 0.67
DAO P14920 1/20 0.67
ALDH1A1 P00352 3/20 0.61
HCAR2 Q8TDS4 2/20 0.61
APP P05067 1/20 0.61
GAA P10253 1/20 0.61
HCAR3 P49019 1/20 0.61
CES2 O00748 2/20 0.56
CES1 P23141 2/20 0.56
SRD5A2 P31213 1/20 0.56
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
MKNK1 Q9BUB5 1/20 0.52
MKNK2 Q9HBH9 1/20 0.52
TP53 P04637 1/20 0.50
KMO O15229 1/20 0.48
PLOD2 O00469 2/20 0.47
BCAT2 O15382 1/20 0.47
PLOD3 O60568 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 SCHEMBL28647367 0.98 NAPRT (0.64) NAPRTTSHRDAOALDH1A1HCAR2
Benzoic Acid SCHEMBL27833807 0.98 NAPRT (0.64) NAPRTTSHRDAOALDH1A1HCAR2
Benzoic Acid SCHEMBL27846116 0.98 NAPRT (0.64) NAPRTTSHRDAOALDH1A1HCAR2
Benzoic Acid SCHEMBL27780742 0.90 NAPRT (0.54) NAPRTTSHRDAOALDH1A1HCAR2
Benzoic Acid SCHEMBL30336127 0.88 NAPRT (0.52) NAPRTTSHRDAOALDH1A1HCAR2
Benzoic Acid SCHEMBL28523082 0.88 NAPRT (0.70) NAPRTTSHRDAOALDH1A1HCAR2
Benzoic Acid SCHEMBL3811105 0.88 NAPRT (0.70) NAPRTTSHRDAOALDH1A1HCAR2
Benzoic Acid SCHEMBL28274408 0.88 NAPRT (0.70) NAPRTTSHRDAOALDH1A1HCAR2
Benzophenone SCHEMBL4016306 0.86 KMT2A (0.71) ALDH1A1HCAR2APPGAAHCAR3
Benzoic Acid SCHEMBL3847226 0.86 NAPRT (0.67) NAPRTTSHRDAOALDH1A1HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119730951-A Method for producing microparticles 巴斯夫欧洲公司 2025-03-28 CN disclosed
CN-114599644-B Nicotinamide compound and herbicide composition containing the same 韩国化学研究院 2024-08-02 CN disclosed
CN-114599644-A Nicotinamide compound and herbicide composition containing the same 韩国化学研究院 2022-06-07 CN disclosed
CN-110402924-A Transplanted rice field super large age barnyard grass control method HUAIAN CITY PLANT PROT AND INSPECTION STATION 2019-11-05 CN disclosed
CN-109717196-A A kind of Herbicidal combinations comprising penoxsuam, bispyribac-sodium and propanil 佛山市盈辉作物科学有限公司 2019-05-07 CN disclosed
CN-106719733-A A kind of rice field complex herbicidal composition 浙江天丰生物科学有限公司 2017-05-31 CN disclosed
CN-103271063-B Weeding composition JIANGSU ROTAM CHEMISTRY CO LTD 2015-05-27 CN disclosed
CN-102170780-B Composition for improving the efficacy of herbicides BASF SE 2014-09-17 CN disclosed
CN-103271063-A Weeding composition JIANGSU ROTAM CHEMISTRY CO LTD 2013-09-04 CN disclosed
CN-101151291-B Polymer compositions and their use in the production of active or effective ingredient compositions BASF AG 2011-10-12 CN disclosed
US-20060030573-A1 Substituted quinazolinone compounds BOYCE RUSTUM S 2006-02-09 US disclosed
EP-1551834-A1 SUBSTITUTED QUINAZOLINONE COMPOUNDS CHIRON CORPORATION (US) 2005-07-13 EP disclosed
US-20050059662-A1 Substituted quinazolinone compounds CHIRON CORPORATION 2005-03-17 US disclosed
WO-2004112793-A1 GUANIDINO-SUBSTITUTED QUINAZOLINONE COMPOUNDS AS MC4-R AGONISTS CHIRON CORPORATION (US) 2004-12-29 WO disclosed
US-20040019049-A1 Substituted quinazolinone compounds CHIRON CORPORATION 2004-01-29 US disclosed
WO-2003099818-A1 SUBSTITUTED QUINAZOLINONE COMPOUNDS CHIRON CORPORATION (US) 2003-12-04 WO disclosed
US-5380460-A Ferroelectric liquid crystal compounds containing chiral haloalkoxy tail units and compositions containing them DISPLAYTECH, INC. (US) 1995-01-10 US disclosed
EP-0589947-A1 SULPHONAMIDE HERBICIDES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1994-04-06 EP disclosed
WO-1993006192-A1 FERROELECTRIC LIQUID CRYSTAL COMPOUNDS CONTAINING CHIRAL HALOALKOXY TAIL UNITS AND COMPOSITIONS CONTAINING THEM DISPLAYTECH, INCORPORATED (US) 1993-04-01 WO disclosed
WO-1992022538-A1 SULPHONAMIDE HERBICIDES SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1992-12-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050059662-A1 Substituted quinazolinone compounds MC4R, MC2R, MC3R NAPRT 2255/4885TSHR 295/4885DAO 3959/4885
US-20040019049-A1 Substituted quinazolinone compounds MC4R, MC2R, MC3R NAPRT 2202/4885TSHR 250/4885DAO 3515/4885
US-20060030573-A1 Substituted quinazolinone compounds MC4R, MC2R, MC3R NAPRT 2184/4885TSHR 250/4885DAO 3381/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.