SCHEMBL6380898

SCHEMBL6380898

CCOc1cc2ncc(C#N)c(NCc3ccc(F)c(F)c3)c2cc1OCC

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 12/20 0.62
▸ ERBB2 P04626 10/20 0.62
▸ SRC P12931 6/20 0.56
▸ STK4 Q13043 2/20 0.49
▸ MAP2K1 Q02750 1/20 0.46

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
SCHEMBL6382357 0.85 SRC (0.61) EGFRERBB2SRCSTK4MAP2K1
SCHEMBL6381758 0.85 SRC (0.60) EGFRERBB2SRCMAP2K1
SCHEMBL6381930 0.85 EGFR (0.60) EGFRERBB2SRCSTK4MAP2K1
SCHEMBL6386181 0.83 EGFR (0.43) EGFRERBB2SRCSTK4
SCHEMBL6381492 0.82 EGFR (0.71) EGFRERBB2SRCSTK4MAP2K1
SCHEMBL6381772 0.77 EGFR (0.56) EGFRERBB2SRCSTK4MAP2K1
SCHEMBL6383515 0.76 EGFR (1.00) EGFRERBB2SRCSTK4MAP2K1
SCHEMBL6380418 0.76 EGFR (0.79) EGFRERBB2SRCSTK4MAP2K1
SCHEMBL27433614 0.74 STK4 (0.55) EGFRERBB2SRCSTK4MAP2K1
SCHEMBL6382094 0.74 EGFR (0.80) EGFRERBB2SRCSTK4

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 13 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
CN-1429126-A Use of cyanoquinolines for treating or inhibiting colonic polyps AMERICAN CYANAMID CO (US) 2003-07-09 — — CN claimed
US-6384051-B1 ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY 2002-05-07 — — US claimed
US-6002008-A Substituted 3-cyano quinolines AMERICAN CYANAMID COMPANY 1999-12-14 — — US claimed
EP-1263503-B1 USE OF CYANOQUINOLINES FOR TREATING OR INHIBITING COLONIC POLYPS WYETH CORP (US) 2005-11-02 — — EP disclosed
CN-1190197-C Application of cyanoquinoline in preparing medicine for treating or inhibiting colonic polyp HEWLETT HOLDINGS CORP (US) 2005-02-23 — — CN disclosed
EP-0973746-B1 SUBSTITUTED 3-CYANO QUINOLINES WYETH CORP (US) 2003-09-24 — — EP disclosed
CN-1429126-A Use of cyanoquinolines for treating or inhibiting colonic polyps AMERICAN CYANAMID CO (US) 2003-07-09 — — CN disclosed
US-6384051-B1 ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY 2002-05-07 — — US disclosed
EP-0973746-A1 SUBSTITUTED 3-CYANO QUINOLINES American Cyanamid Company (US) 2000-01-26 — — EP disclosed
US-6002008-A Substituted 3-cyano quinolines AMERICAN CYANAMID COMPANY 1999-12-14 — — US disclosed
WO-1998043960-A1 SUBSTITUTED 3-CYANO QUINOLINES AMERICAN CYANAMID COMPANY (US) 1998-10-08 — — WO disclosed
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