SCHEMBL2200319

SCHEMBL2200319

C#Cc1cccc(C(=O)O)c1C#C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
NR4A1 P22736 1/20 0.39
NR4A2 P43354 1/20 0.39
NR4A3 Q92570 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
NAPRT Q6XQN6 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
HMGB1 P09429 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
HSD17B10 Q99714 2/20 0.38

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
SCHEMBL30626597 1.00 ALDH1A1 (0.44) ALDH1A1ALOX15TSHRNR4A1NR4A2
SCHEMBL1712400 0.87 ALDH1A1 (0.52) ALDH1A1ALOX15TSHRNR4A1NR4A2
Hydrochloric Acid SCHEMBL6349434 0.85 ALDH1A1 (0.50) ALDH1A1ALOX15TSHRNR4A1NR4A2
SCHEMBL2746786 0.83 HSD17B10 (0.40) ALDH1A1ALOX15TSHRNR4A1NR4A2
SCHEMBL7557427 0.82 AKR1C3 (0.48) ALDH1A1NR4A1KDM4EMAPTPOLB
SCHEMBL5004422 0.82 PTPN22 (0.47) ALDH1A1ALOX15TSHRNR4A1NR4A2
SCHEMBL5668193 0.82 HSD17B10 (0.48) ALDH1A1ALOX15TSHRNR4A1NR4A2
SCHEMBL5666504 0.82 ALDH1A1 (0.46) ALDH1A1ALOX15TSHRNR4A1NR4A2
SCHEMBL688471 0.81 ALDH1A1 (0.56) ALDH1A1ALOX15TSHRNR4A1NR4A2
Benzene SCHEMBL29290216 0.81 ALDH1A1 (0.56) ALDH1A1ALOX15TSHRNR4A1NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11906493-B2 Gas sensors and methods of sensing a gas-phase analyte ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2024-02-20 US disclosed
EP-4279913-A2 ACOUSTIC WAVE SENSORS AND METHODS OF SENSING A GAS-PHASE ANALYT Rohm and Haas Electronic Materials LLC (US) 2023-11-22 EP disclosed
EP-3511709-B1 ACOUSTIC WAVE SENSORS AND METHODS OF SENSING A GAS-PHASE ANALYTE ROHM & HAAS ELECT MAT (US) 2023-11-01 EP disclosed
US-11746254-B2 Tunable refractive index polymers ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2023-09-05 US disclosed
US-11360387-B2 Silicon-containing underlayers ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2022-06-14 US disclosed
US-20190041751-A1 SILICON-CONTAINING UNDERLAYERS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2019-02-07 US disclosed
EP-1909142-B1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION ENHANCER TORAY INDUSTRIES (JP) 2015-06-24 EP disclosed
US-7977028-B2 Photosensitive resin composition and adhesion promoter TORAY INDUSTRIES, INC. (JP) 2011-07-12 US disclosed
US-20090123867-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION PROMOTER TORAY INDUSTRIES, INC. (JP) 2009-05-14 US disclosed
EP-1909142-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION ENHANCER TORAY INDUSTRIES, INC. (JP) 2008-04-09 EP disclosed
EP-0952975-A1 BI-AROMATIC COMPOUNDS BOUND BY A HETEROETHYNYLENE RADICAL AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME Galderma Research & Development (FR) 1999-11-03 EP disclosed
WO-1999010322-A1 BI-AROMATIC COMPOUNDS BOUND BY A HETEROETHYNYLENE RADICAL AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RESEARCH & DEVELOPMENT (FR) 1999-03-04 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 (1 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-20090123867-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION PROMOTER PCNA, TERB1, SMC2 ALDH1A1 1144/4885ALOX15 919/4885TSHR 4306/4885

“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.