SCHEMBL7992159

SCHEMBL7992159

O=C(O)c1nc(-c2ccc(F)cc2)[nH]c1-c1ccncc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.68
MAPK11 Q15759 14/20 0.68
MAPK13 O15264 13/20 0.68
MAPK12 P53778 13/20 0.68
ALOX5 P09917 11/20 0.68
TGFBR1 P36897 2/20 0.68
GCGR P47871 11/20 0.62
CSNK1A1 P48729 4/20 0.62
CSNK1D P48730 4/20 0.62
PRKD3 O94806 3/20 0.62
MAP4K4 O95819 3/20 0.62
FRK P42685 3/20 0.62
MAPK9 P45984 3/20 0.62
GSK3B P49841 3/20 0.62
PTK6 Q13882 3/20 0.62
CLK4 Q9HAZ1 2/20 0.62
PRKD2 Q9BZL6 2/20 0.62
ALDH1A1 P00352 4/20 0.59
RIPK2 O43353 3/20 0.59
CYP3A4 P08684 3/20 0.59

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
SCHEMBL7992089 0.87 MAPK14 (0.62) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL7995288 0.86 MAPK13 (0.52) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL7989925 0.86 MAPK14 (0.62) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL7992039 0.86 MAPK14 (0.56) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL7977738 0.86 MAPK14 (0.56) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL15075613 0.82 MAPK13 (0.63) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL7995495 0.82 MAPK13 (0.63) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL7991943 0.82 MAPK14 (0.58) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL413667 0.81 MAPK14 (1.00) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL7988678 0.81 MAPK14 (0.61) MAPK14MAPK11MAPK13MAPK12ALOX5

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
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed