SCHEMBL14110012

SCHEMBL14110012

CON(C)C(=O)C(=O)c1c[nH]c2nc(C)c(C(=O)N3C[C@H](C)N(Cc4ccc(F)cc4)C[C@H]3C)cc12

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.51
MAPK11 Q15759 2/20 0.51
MAPK13 O15264 1/20 0.51
MAPK12 P53778 1/20 0.51
NQO2 P16083 1/20 0.51
MAPKAPK2 P49137 1/20 0.51
ACTR2 P61160 1/20 0.51
CCR1 P32246 9/20 0.41

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
SCHEMBL4877621 0.92 MAPK14 (0.60) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL14109949 0.90 MAPK14 (0.52) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL6493985 0.87 MAPK14 (0.47) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL6492462 0.86 MAPK14 (0.47) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL4877440 0.85 MAPK14 (0.66) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL6504945 0.85 MAPK14 (0.46) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL14110009 0.84 MAPK14 (0.45) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL6503638 0.84 MAPK14 (0.45) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL14109947 0.84 MAPK14 (0.45) MAPK14MAPK11MAPK13MAPK12NQO2
SCHEMBL4830562 0.83 MAPK14 (0.57) MAPK14MAPK11MAPK13MAPK12NQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7393851-B2 Azaindole derivatives as inhibitors of p38 kinase SCIOS, INC. (US) 2008-07-01 US disclosed
US-7393851-B2 Azaindole derivatives as inhibitors of p38 kinase SCIOS, INC. (US) 2008-07-01 US disclosed