SCHEMBL27893943

SCHEMBL27893943

N#Cc1cnc2cc(OC3CCOC3)c(NC(=O)/C=C\CNN)cc2c1Nc1ccc(OCc2cccc(F)c2)c(Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.66
▸ ERBB2 P04626 16/20 0.65
▸ ERBB4 Q15303 4/20 0.58
▸ ERBB3 P21860 1/20 0.56

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
SCHEMBL27893989 1.00 EGFR (0.66) EGFRERBB2ERBB4ERBB3
SCHEMBL27893965 0.94 EGFR (0.64) EGFRERBB2
SCHEMBL27911104 0.94 EGFR (0.65) EGFRERBB2
SCHEMBL27911107 0.94 EGFR (0.66) EGFRERBB2
SCHEMBL14854926 0.92 EGFR (0.79) EGFRERBB2
SCHEMBL14855197 0.92 EGFR (0.79) EGFRERBB2
SCHEMBL14854924 0.92 EGFR (0.79) EGFRERBB2
SCHEMBL14855198 0.92 EGFR (0.79) EGFRERBB2
SCHEMBL27893964 0.92 EGFR (0.63) EGFRERBB2
SCHEMBL14854674 0.91 EGFR (0.64) EGFRERBB2ERBB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102933578-A Cyanoquinoline derivatives TIANJIN HEMAY BIO TECH CO LTD 2013-02-13 — — CN claimed
CN-102933578-A Cyanoquinoline derivatives TIANJIN HEMAY BIO TECH CO LTD 2013-02-13 — — CN disclosed
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