SCHEMBL2361668

SCHEMBL2361668

[O-][n+]1cccc2cncnc21

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.44
KDM4E B2RXH2 2/20 0.35
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31

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
SCHEMBL1571887 0.74 KDM4E (0.39) KDM4E
SCHEMBL3279288 0.74 EGFR (0.34) EGFR
SCHEMBL747251 0.69 MMP2 (0.35) EGFRKDM4E
SCHEMBL28665764 0.67
SCHEMBL3854510 0.67 KDM4E (0.37) KDM4E
SCHEMBL367523 0.63 EGFR (0.32) EGFR
SCHEMBL29204081 0.63 PKM (0.30)
SCHEMBL5800131 0.63 TNF (0.34) KDM4E
SCHEMBL13979159 0.62 HTT (0.39) KDM4E
SCHEMBL6870185 0.61 ALDH1A1 (0.52) KDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1333833-B1 Novel trisubstituted-8H-pyrido[2,3-d]pyrimidin-7-one compound for the treatment of CSBP/p38 kinase mediated diseases GLAXOSMITHKLINE LLC (US) 2011-08-24 EP disclosed
EP-1333833-A4 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2007-10-24 EP disclosed
EP-1333833-A2 NOVEL COMPOUNDS SmithKline Beecham Corporation (US) 2003-08-13 EP disclosed
WO-2002059083-A3 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2003-04-10 WO disclosed
WO-2002059083-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2002-08-01 WO disclosed