Benzoic Acid

Benzoic Acid

SCHEMBL407365

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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 4/20 1.00
DAO P14920 1/20 1.00
NAPRT Q6XQN6 1/20 1.00
CES2 O00748 3/20 0.78
CES1 P23141 3/20 0.78
SRD5A2 P31213 2/20 0.78
TP53 P04637 1/20 0.73
ALDH1A1 P00352 2/20 0.65
TRPA1 O75762 1/20 0.59
CA12 O43570 2/20 0.58
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA3 P07451 2/20 0.58
CA4 P22748 2/20 0.58
CA6 P23280 2/20 0.58
CA5A P35218 2/20 0.58
CA7 P43166 2/20 0.58
CA9 Q16790 2/20 0.58
CA14 Q9ULX7 2/20 0.58
CA5B Q9Y2D0 2/20 0.58

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 SCHEMBL4591761 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL149318 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL9751726 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL137419 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL975929 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL11602198 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL3966600 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL976149 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL7719037 1.00 TSHR (1.00) TSHRDAONAPRTCES2CES1
Benzoic Acid SCHEMBL2458489 1.00 TSHR (1.00) 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 746 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230263817-A1 HIGH DOSE NICOTINAMIDE ADENINE DINUCLEOTIDE (NAD) PRECURSOR REGIMENS FOR REDUCTION OF INFLAMMATION IN HUMAN PATIENTS WITH PREEXISTING INFLAMMATION UNIVERSITY OF WASHINGTON (US) 2023-08-24 US claimed
EP-3728187-B1 PROCESS FOR PREPARING A POWDERY ORGANIC PEROXIDE FORMULATION NOURYON CHEMICALS INT BV (NL) 2022-06-22 EP claimed
CN-111557913-B Nano photosensitive compound targeting epileptic cells and regulation and control detection system 中国科学院空天信息创新研究院 2022-05-31 CN claimed
EP-3999051-A2 USE OF A BENZOATE CONTAINING COMPOSITION TO TREAT NEURODEGENERATIVE DISORDERS Rush University Medical Center (US) 2022-05-25 EP claimed
US-20220125814-A1 CANCER COMBINATION THERAPIES UTILIZING A NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITOR IN COMBINATION WITH A NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY PRECURSOR FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2022-04-28 US claimed
CN-109647354-B Application of modified fiber in purifying VOC 郑州大学 2021-12-31 CN claimed
EP-3625290-B1 MULTI-LAYER ANTI-FOG COMPOSITIONS AND PROCESSES FOR MAKING SAME CELANESE INT CORP (US) 2021-12-22 EP claimed
CN-113811287-A Low VOC multifunctional additives for improving aqueous polymer film properties 艾默罗德卡拉玛化学品公司 2021-12-17 CN claimed
CN-113690429-A Carbon-coated graphene/metal oxide composite material and preparation method thereof 武汉立承科技有限公司 2021-11-23 CN claimed
US-10960340-B2 Composition and system for gas storage COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2021-03-30 US claimed
US-5334311-A Resolution of optical isomers DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1994-08-02 US claimed
EP-0411303-B1 Halogen-free melt processable silicone-imide wire coating compositions having low smoke values GEN ELECTRIC (US) 1994-01-12 EP claimed
US-RE34457-E For optical and geometric isomers comprising optionally substituted cellulose tribenzoate supported on porous carrier DAICEL CHEMICAL INDUSTRIES, INC. (JP) 1993-11-30 US claimed
US-5032277-A Chromatography DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1991-07-16 US claimed
EP-0354323-A2 Antidiabetic phosphates AMERICAN CYANAMID COMPANY (US) 1990-02-14 EP claimed
US-4830752-A OPTICAL RESOLUTION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1989-05-16 US claimed
US-4818394-A CELLULOSE TRIBENZOATES ON POROUS CARRIER DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1989-04-04 US claimed
EP-0161118-B1 FLEXIBLE POLYVINYLIDENE FLUORIDE COMPOSITIONS, AND THEIR USE, ESPECIALLY IN MAKING FLEXIBLE TUBES Institut Français du Pétrole (FR) 1988-09-14 EP claimed
US-4745026-A FINE PARTICLE SOLID PLASTICIZER MITSUBISHI PAPER MILLS, LTD. (JP) 1988-05-17 US claimed
EP-0161118-A1 Flexible polyvinylidene fluoride compositions, and their use, especially in making flexible tubes Institut Français du Pétrole (FR) 1985-11-13 EP claimed

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

For each of this compound's patents that has machine-readable text (2 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-20230263817-A1 HIGH DOSE NICOTINAMIDE ADENINE DINUCLEOTIDE (NAD) PRECURSOR REGIMENS FOR REDUCTION OF INFLAMMATION IN HUMAN PATIENTS WITH PREEXISTING INFLAMMATION NAMPT, NNT, NQO1 TSHR 3727/4885DAO 2760/4885NAPRT 5/4885
US-20220125814-A1 CANCER COMBINATION THERAPIES UTILIZING A NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITOR IN COMBINATION WITH A NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY PRECURSOR NAMPT, NADK, NNT TSHR 4201/4885DAO 3842/4885NAPRT 4/4885

“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.