SCHEMBL6384074

SCHEMBL6384074

COc1cc2ncc(C#N)c(Nc3cccc(C=S)c3)c2cc1OC

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 18/20 0.74
▸ ERBB2 P04626 15/20 0.74
▸ GAK O14976 2/20 0.72
▸ MAP2K1 Q02750 2/20 0.70
▸ SRC P12931 1/20 0.69
▸ RAF1 P04049 1/20 0.68

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
SCHEMBL6381446 0.85 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC
SCHEMBL6381535 0.85 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC
SCHEMBL28756490 0.84 MAP2K1 (0.95) EGFRERBB2GAKMAP2K1SRC
SCHEMBL6381313 0.84 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC
SCHEMBL6381060 0.84 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC
SCHEMBL6382117 0.84 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC
SCHEMBL6381853 0.84 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC
SCHEMBL6380423 0.82 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC
SCHEMBL6382213 0.82 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC
SCHEMBL6381708 0.82 EGFR (1.00) EGFRERBB2GAKMAP2K1SRC

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 12 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
US-6384051-B1 ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY 2002-05-07 — — US claimed
EP-0973746-A1 SUBSTITUTED 3-CYANO QUINOLINES American Cyanamid Company (US) 2000-01-26 — — EP claimed
US-6002008-A Substituted 3-cyano quinolines AMERICAN CYANAMID COMPANY 1999-12-14 — — US claimed
WO-1998043960-A1 SUBSTITUTED 3-CYANO QUINOLINES AMERICAN CYANAMID COMPANY (US) 1998-10-08 — — WO claimed
EP-1263503-B1 USE OF CYANOQUINOLINES FOR TREATING OR INHIBITING COLONIC POLYPS WYETH CORP (US) 2005-11-02 — — EP disclosed
EP-0973746-B1 SUBSTITUTED 3-CYANO QUINOLINES WYETH CORP (US) 2003-09-24 — — EP disclosed
EP-1263503-A2 USE OF CYANOQUINOLINES FOR TREATING OR INHIBITING COLONIC POLYPS AMERICAN CYANAMID COMPANY (US) 2002-12-11 — — EP disclosed
US-6384051-B1 ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY 2002-05-07 — — US disclosed
WO-2001068186-A2 USE OF CYANOQUINOLINES FOR TREATING OR INHIBITING COLONIC POLYPS AMERICAN CYANAMID COMPANY (US) 2001-09-20 — — WO disclosed
US-6002008-A Substituted 3-cyano quinolines AMERICAN CYANAMID COMPANY 1999-12-14 — — US disclosed
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