SCHEMBL20674510

SCHEMBL20674510

CNC(=O)c1nc(O)n2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.44
▸ NTRK1 P04629 1/20 0.44
▸ HTR4 Q13639 7/20 0.42
▸ CYP3A4 P08684 3/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ GAA P10253 2/20 0.41
▸ YTHDC1 Q96MU7 1/20 0.39
▸ OPRM1 P35372 1/20 0.39
▸ OPRD1 P41143 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ OGFRL1 Q5TC84 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PIN1 Q13526 1/20 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
SCHEMBL20674150 0.82 BAZ2B (0.46) CNR2ALDH1A1GAAKDM4EKMT2A
SCHEMBL13369603 0.80 PTPN1 (0.53) CNR2ALDH1A1OPRM1OPRD1OPRK1
SCHEMBL20674161 0.79 MAP2K3 (0.46) CNR2ALDH1A1GAAKDM4EKMT2A
SCHEMBL20674151 0.76 ALDH1A1 (0.38) CNR2HTR4ALDH1A1GAAKDM4E
SCHEMBL20673884 0.73 USP7 (0.48) ALDH1A1GAAKDM4EKMT2A
SCHEMBL20673874 0.73 USP7 (0.53) ALDH1A1KDM4EKMT2A
SCHEMBL20674504 0.71 PTPN1 (0.56) ALDH1A1GAAKDM4EKMT2A
SCHEMBL23937876 0.70 YTHDC1 (0.40) NTRK1CYP3A4GAAYTHDC1OPRM1
SCHEMBL20673892 0.68 ADRA1B (0.43) CNR2ALDH1A1KDM4EKMT2A
SCHEMBL20674153 0.68 BAZ2B (0.41) CYP3A4CYP2D6ALDH1A1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3399968-B1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS PHARMATECH LTD (KY) 2021-10-20 — — EP disclosed
US-10435388-B2 Selective inhibitors of clinically important mutants of the EGFR tyrosine kinase CS PHARMATECH LIMITED (KY) 2019-10-08 — — US disclosed
US-20190023689-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE HIGH GREAT INVESTMENT LIMITED (HK) 2019-01-24 — — US 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-10435388-B2 Selective inhibitors of clinically important mutants of the EGFR tyrosine kinase EGFR, ERBB3, ERBB2 CNR2 4009/4885NTRK1 242/4885HTR4 4566/4885
US-20190023689-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE EGFR, ERBB3, ERBB2 CNR2 4009/4885NTRK1 242/4885HTR4 4566/4885

“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.

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