SCHEMBL27911181

SCHEMBL27911181

CC(=O)Nc1cc2c(Nc3ccc(Oc4ccccn4)c(Cl)c3)c(C#N)cnc2cc1OC1CCOC1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ STK3 Q13188 5/20 0.59
▸ STK4 Q13043 7/20 0.56
▸ EGFR P00533 11/20 0.52
▸ ERBB2 P04626 5/20 0.50
▸ SRC P12931 1/20 0.50
▸ KDR P35968 1/20 0.50
▸ BTK Q06187 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
SCHEMBL27893924 0.93 STK4 (0.62) STK3STK4EGFRERBB2SRC
SCHEMBL27893984 0.92 EGFR (0.51) STK3STK4EGFRERBB2SRC
SCHEMBL27893921 0.92 EGFR (0.55) STK3STK4EGFRERBB2SRC
SCHEMBL28804928 0.92 EGFR (0.63) STK3EGFRERBB2SRCKDR
SCHEMBL14855103 0.90 STK3 (0.75) STK3STK4EGFRERBB2SRC
SCHEMBL27894009 0.89 EGFR (0.56) STK3STK4EGFRERBB2SRC
SCHEMBL27893975 0.89 EGFR (0.48) STK3STK4EGFRERBB2SRC
SCHEMBL27893963 0.89 EGFR (0.52) STK3STK4EGFRERBB2SRC
SCHEMBL27893927 0.88 EGFR (0.55) STK3STK4EGFRERBB2SRC
SCHEMBL27893988 0.87 EGFR (0.51) STK3STK4EGFRERBB2SRC

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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