SCHEMBL19389771

SCHEMBL19389771

C=Cc1cccc(Nc2c(C#N)cnc3cc(C)c(NCC)cc23)c1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 17/20 0.49
▸ ERBB2 P04626 15/20 0.49
▸ STK4 Q13043 3/20 0.49
▸ GAK O14976 2/20 0.46

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
SCHEMBL18933465 0.85 EGFR (0.64) EGFRERBB2STK4GAK
SCHEMBL18933435 0.82 EGFR (0.50) EGFRERBB2STK4GAK
SCHEMBL21573295 0.81 EGFR (0.55) EGFRERBB2STK4GAK
SCHEMBL21573318 0.81 SRC (0.52) EGFRERBB2STK4GAK
SCHEMBL18933434 0.75 EGFR (0.56) EGFRERBB2STK4GAK
SCHEMBL18949482 0.74 EGFR (0.60) EGFRERBB2STK4GAK
SCHEMBL18949427 0.74 EGFR (0.58) EGFRERBB2STK4GAK
SCHEMBL21573263 0.71 EGFR (0.58) EGFRERBB2STK4GAK
SCHEMBL19223046 0.70 EGFR (0.48) EGFRERBB2STK4GAK
SCHEMBL19223056 0.70 EGFR (0.55) EGFRERBB2STK4GAK

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-A1 CYANOQUINOLINE DERIVATIVES TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2017-09-27 — — EP disclosed
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