Benzoic Acid

Benzoic Acid

SCHEMBL976149

O=C(O)c1ccccc1.O=C(O)c1ccccc1.O=C(O)c1ccccc1.O=C(O)c1ccccc1.O=C(O)c1ccccc1.O=C(O)c1ccccc1.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 SCHEMBL407365 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 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720889-B1 SULFATED OLIGOSACCHARIDE DERIVATIVES PROGEN PHARMACEUTICALS LTD (AU) 2014-11-26 EP disclosed
US-8173606-B2 Sulfated oligosaccharide derivatives PROGEN PHARMACEUTICALS LIMITED (AU) 2012-05-08 US disclosed
US-20110130354-A1 SULFATED OLIGOSACCHARIDE DERIVATIVES PROGEN PHARMACEUTICALS LIMITED (AU) 2011-06-02 US disclosed
US-7875592-B2 inhibitors of heparan sulfate-binding proteins and inhibitors of the enzyme heparanase; antiangiogenic, antimetastatic, anti-inflammatory, antimicrobial, anticoagulant and/or antithrombotic treatment, lowering of blood triglyceride levels and inhibition of cardiovascular disease PROGEN PHARMACEUTICALS LIMITED (AU) 2011-01-25 US disclosed
EP-1720889-A4 SULFATED OLIGOSACCHARIDE DERIVATIVES PROGEN PHARMACEUTICALS LTD (AU) 2008-03-19 EP disclosed
US-20070185037-A1 Sulfated oligosaccharide derivatives PROGEN INDUSTRIES LIMITED (AU) 2007-08-09 US disclosed
EP-1720889-A1 SULFATED OLIGOSACCHARIDE DERIVATIVES Progen Industries Limited (AU) 2006-11-15 EP disclosed
WO-2005085264-A1 SULFATED OLIGOSACCHARIDE DERIVATIVES PROGEN INDUSTRIES LIMITED (AU) 2005-09-15 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 (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-20070185037-A1 Sulfated oligosaccharide derivatives HPSE, APOB, LIPG TSHR 2610/4885DAO 2287/4885NAPRT 1043/4885
US-20110130354-A1 SULFATED OLIGOSACCHARIDE DERIVATIVES HPSE, APOB, LIPG TSHR 2610/4885DAO 2287/4885NAPRT 1043/4885

“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.