SCHEMBL27893977

SCHEMBL27893977

C#Cc1cccc(Nc2c(C#N)cnc3cc(OC4CCOC4)c(NC(=O)/C=C/CNN)cc23)c1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.66
▸ ERBB2 P04626 5/20 0.54
▸ GAK O14976 1/20 0.48

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
SCHEMBL27911109 1.00 EGFR (0.66) EGFRERBB2GAK
SCHEMBL17254438 0.92 EGFR (0.65) EGFRERBB2GAK
SCHEMBL17254436 0.92 EGFR (0.65) EGFRERBB2GAK
SCHEMBL14864925 0.92 EGFR (0.65) EGFRERBB2GAK
SCHEMBL17254437 0.92 EGFR (0.65) EGFRERBB2GAK
SCHEMBL27911179 0.92 EGFR (0.65) EGFRERBB2
SCHEMBL28801408 0.92 EGFR (0.65) EGFRERBB2
SCHEMBL14854956 0.91 EGFR (0.63) EGFRERBB2
SCHEMBL14854954 0.91 EGFR (0.63) EGFRERBB2
SCHEMBL14854959 0.91 EGFR (0.63) 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
CN-102933578-A Cyanoquinoline derivatives TIANJIN HEMAY BIO TECH CO LTD 2013-02-13 — — CN claimed
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