SCHEMBL6384283

SCHEMBL6384283

CN(C)Cc1cc(N)c2ncc(C#N)c(Nc3cccc(Br)c3)c2c1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.52
ERBB2 P04626 16/20 0.52
GAK O14976 1/20 0.52

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
SCHEMBL6381927 0.85 EGFR (0.51) EGFRERBB2GAK
SCHEMBL1893072 0.85 EGFR (0.55) EGFRERBB2GAK
SCHEMBL6383209 0.84 EGFR (0.56) EGFRERBB2
SCHEMBL6383946 0.81 EGFR (0.61) EGFRERBB2GAK
SCHEMBL6379739 0.81 EGFR (0.62) EGFRERBB2GAK
SCHEMBL4961565 0.80 EGFR (0.58) EGFRERBB2GAK
SCHEMBL1892093 0.77 EGFR (0.51) EGFRERBB2GAK
SCHEMBL6383202 0.77 EGFR (0.60) EGFRERBB2
SCHEMBL4962089 0.76 MAP3K8 (0.57) EGFRERBB2GAK
SCHEMBL1896747 0.75 EGFR (0.68) EGFRERBB2GAK

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