SCHEMBL6380477

SCHEMBL6380477

CCN(CC)CC=CC(=O)Nc1cc2c(Nc3cccc(Br)c3)c(C#N)cnc2cc1OC

nearest known ligand 0.86

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.86
ERBB2 P04626 19/20 0.86
GAK O14976 1/20 0.61

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
SCHEMBL6383772 0.94 EGFR (0.88) EGFRERBB2GAK
SCHEMBL1418630 0.93 EGFR (0.78) EGFRERBB2
SCHEMBL1418628 0.93 EGFR (0.78) EGFRERBB2
SCHEMBL6384606 0.93 EGFR (1.00) EGFRERBB2
SCHEMBL1417990 0.92 EGFR (0.80) EGFRERBB2
SCHEMBL1417992 0.92 EGFR (0.80) EGFRERBB2
SCHEMBL6381497 0.89 EGFR (0.83) EGFRERBB2GAK
SCHEMBL6381499 0.89 EGFR (0.83) EGFRERBB2GAK
SCHEMBL1417858 0.89 EGFR (0.82) EGFRERBB2
SCHEMBL1417860 0.89 EGFR (0.82) 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 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