SCHEMBL20311409

SCHEMBL20311409

N=C(Nc1ccc(CN(N)/C=C\N)cc1)c1c(N)cc[nH]c1=O

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.37

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
SCHEMBL20246588 0.79 EGFR (0.38) EGFR
SCHEMBL20310858 0.76 EGFR (0.40) EGFR
SCHEMBL20311130 0.75 EGFR (0.44) EGFR
SCHEMBL16623589 0.74 EGFR (0.43) EGFR
SCHEMBL20311022 0.74 EGFR (0.42) EGFR
SCHEMBL20246564 0.74 PTGS1 (0.43) EGFR
SCHEMBL20310852 0.73 EGFR (0.36) EGFR
SCHEMBL20245973 0.71 EGFR (0.44) EGFR
SCHEMBL20246267 0.70 EGFR (0.43) EGFR
SCHEMBL20311191 0.68 EGFR (0.42) EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2976339-B1 GEMINALLY SUBSTITUTED CYANOETHYLPYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME (US) 2018-06-27 EP disclosed