SCHEMBL6380919

SCHEMBL6380919

CCOc1cc2ncc(C#N)c(Nc3cccc(Br)c3)c2cc1NC(=O)C=CCN1CCOCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 1.00
▸ ERBB2 P04626 18/20 1.00

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
SCHEMBL6382006 0.94 EGFR (1.00) EGFRERBB2
SCHEMBL8150053 0.87 EGFR (0.84) EGFRERBB2
SCHEMBL6382071 0.87 EGFR (0.84) EGFRERBB2
SCHEMBL6385833 0.85 EGFR (1.00) EGFRERBB2
SCHEMBL8150230 0.85 EGFR (1.00) EGFRERBB2
SCHEMBL6383772 0.85 EGFR (0.88) EGFRERBB2
SCHEMBL1418005 0.84 EGFR (0.77) EGFRERBB2
SCHEMBL1418008 0.84 EGFR (0.77) EGFRERBB2
SCHEMBL6383578 0.83 EGFR (0.85) EGFRERBB2
SCHEMBL6383583 0.83 EGFR (0.85) 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 1 patent. 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
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