SCHEMBL21569112

SCHEMBL21569112

COC(C)(NC/C=C/C(=O)Nc1cc2c(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c(C#N)cnc2cc1OC1CCOC1)OC

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.64
▸ ERBB2 P04626 17/20 0.63
▸ ERBB4 Q15303 1/20 0.55

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
SCHEMBL14854672 1.00 EGFR (0.64) EGFRERBB2ERBB4
SCHEMBL14854668 1.00 EGFR (0.64) EGFRERBB2ERBB4
SCHEMBL14854674 1.00 EGFR (0.64) EGFRERBB2ERBB4
SCHEMBL27893943 0.91 EGFR (0.66) EGFRERBB2ERBB4
SCHEMBL27893989 0.91 EGFR (0.66) EGFRERBB2ERBB4
SCHEMBL14854671 0.91 EGFR (0.64) EGFRERBB2ERBB4
SCHEMBL14854670 0.91 EGFR (0.64) EGFRERBB2ERBB4
SCHEMBL14855198 0.90 EGFR (0.79) EGFRERBB2
SCHEMBL14854924 0.90 EGFR (0.79) EGFRERBB2
SCHEMBL14855197 0.90 EGFR (0.79) EGFRERBB2

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-3222620-B1 CYANOQUINOLINE DERIVATIVES TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO LTD (CN) 2019-11-20 — — EP claimed
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