SCHEMBL7206018

SCHEMBL7206018

CN(C)Cc1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccnc(Oc4ccccc4)c3)[nH]2)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.64
MAPK14 Q16539 14/20 0.50
MAPK13 O15264 8/20 0.49
MAPK12 P53778 8/20 0.49
MAPK11 Q15759 8/20 0.49
GCGR P47871 7/20 0.49
PRKD3 O94806 1/20 0.45
MAP4K4 O95819 1/20 0.45
FRK P42685 1/20 0.45
MAPK9 P45984 1/20 0.45
CSNK1A1 P48729 1/20 0.45
CSNK1D P48730 1/20 0.45
GSK3B P49841 1/20 0.45
PTK6 Q13882 1/20 0.45
PRKD2 Q9BZL6 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45

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
SCHEMBL7209158 0.84 MAPK14 (0.62) ALOX5MAPK14MAPK13MAPK12MAPK11
SCHEMBL4584148 0.83 ALOX5 (0.58) ALOX5MAPK14MAPK13MAPK12MAPK11
SCHEMBL4552013 0.79 ALOX5 (1.00) ALOX5MAPK14MAPK13MAPK12MAPK11
SCHEMBL7209162 0.79 MAPK14 (0.55) ALOX5MAPK14MAPK13MAPK12MAPK11
SCHEMBL13712660 0.75 MAPK14 (0.83) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4565990 0.75 ALOX5 (1.00) ALOX5MAPK14MAPK13MAPK12MAPK11
SCHEMBL4585785 0.74 ALOX5 (0.64) ALOX5MAPK14MAPK13MAPK12MAPK11
SCHEMBL2650007 0.73 MAPK14 (0.81) ALOX5MAPK14MAPK13MAPK12MAPK11
SCHEMBL4585131 0.72 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL9194658 0.70 MAPK13 (0.67) ALOX5MAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610695-B1 Prophylaxis or treatment of CSBP/RK/p38 kinase mediated disease SMITHKLINE BEECHAM CORPORATION 2003-08-26 US disclosed
EP-0994870-A4 NOVEL ARYLOXY SUBSTITUTED PYRIMIDINE IMIDAZOLE COMPOUNDS SMITHKLINE BEECHAM (US) 2002-10-23 EP disclosed
EP-0994870-A1 NOVEL ARYLOXY SUBSTITUTED PYRIMIDINE IMIDAZOLE COMPOUNDS Smithkline Beecham (US) 2000-04-26 EP disclosed
WO-1998057966-A1 NOVEL ARYLOXY SUBSTITUTED PYRIMIDINE IMIDAZOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1998-12-23 WO disclosed