SCHEMBL6384653

SCHEMBL6384653

N#Cc1cnc2c(N)cccc2c1Nc1ccc(F)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP3K8 P41279 15/20 0.49
EGFR P00533 7/20 0.47
MAPKAPK2 P49137 2/20 0.47
SRC P12931 1/20 0.47
MAPK14 Q16539 1/20 0.47
LCK P06239 1/20 0.46
CYP3A4 P08684 1/20 0.46
RPS6KB1 P23443 1/20 0.46
MAPK8 P45983 1/20 0.46
ERBB2 P04626 3/20 0.44

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
SCHEMBL6382258 0.90 EGFR (0.47) MAP3K8EGFRMAPKAPK2SRCMAPK14
SCHEMBL6383964 0.90 MAP3K8 (0.47) MAP3K8EGFRMAPKAPK2SRCMAPK14
SCHEMBL6383708 0.87 EGFR (0.59) MAP3K8EGFRMAPKAPK2SRCMAPK14
SCHEMBL6383946 0.84 EGFR (0.61) EGFRERBB2
SCHEMBL6384102 0.84 EGFR (0.58) MAP3K8EGFRERBB2
SCHEMBL6386289 0.84 EGFR (0.52) EGFRERBB2
SCHEMBL6382269 0.83 MAP3K8 (0.46) MAP3K8EGFRMAPKAPK2SRCMAPK14
SCHEMBL6384067 0.82 EGFR (0.58) MAP3K8EGFRSRCERBB2
SCHEMBL6379765 0.81 EGFR (0.57) MAP3K8EGFRERBB2
SCHEMBL6382251 0.81 EGFR (0.54) MAP3K8EGFRSRCERBB2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263503-B1 USE OF CYANOQUINOLINES FOR TREATING OR INHIBITING COLONIC POLYPS WYETH CORP (US) 2005-11-02 EP claimed
EP-0973746-B1 SUBSTITUTED 3-CYANO QUINOLINES WYETH CORP (US) 2003-09-24 EP claimed