SCHEMBL21568986

SCHEMBL21568986

N#Cc1cnc2c(NC(=O)c3ccccc3)c(OC3CCOC3)ccc2c1Nc1ccc(OCc2ccccn2)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 13/20 0.53
▸ STK3 Q13188 6/20 0.52
▸ STK4 Q13043 5/20 0.52
▸ ERBB2 P04626 5/20 0.49
▸ SRC P12931 1/20 0.49
▸ KDR P35968 1/20 0.49
▸ BTK Q06187 1/20 0.49

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
SCHEMBL21568987 0.92 STK3 (0.60) EGFRSTK3STK4ERBB2SRC
SCHEMBL21569029 0.91 STK4 (0.61) EGFRSTK3STK4ERBB2SRC
SCHEMBL21568985 0.90 EGFR (0.64) EGFRSTK3STK4ERBB2SRC
SCHEMBL21568982 0.89 EGFR (0.55) EGFRSTK3STK4ERBB2SRC
SCHEMBL21568992 0.89 EGFR (0.55) EGFRSTK3STK4ERBB2SRC
SCHEMBL14854663 0.89 STK3 (0.64) EGFRSTK3STK4ERBB2SRC
SCHEMBL21569117 0.87 EGFR (0.52) EGFRSTK3STK4ERBB2SRC
SCHEMBL21569007 0.87 EGFR (0.67) EGFRSTK3STK4ERBB2SRC
SCHEMBL21568971 0.87 EGFR (0.67) EGFRSTK3STK4ERBB2SRC
SCHEMBL21568966 0.87 EGFR (0.67) EGFRSTK3STK4ERBB2SRC

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
Send feedback