SCHEMBL14109166

SCHEMBL14109166

COc1nc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)N1CC[C@H](O)C1)cn2N

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.54
MLNR O43193 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
CHRM2 P08172 1/20 0.38

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
SCHEMBL14109213 0.92 MAPK14 (0.62) MAPK14MLNRCYP3A4CYP2C9CYP2C19
SCHEMBL6494994 0.92 MAPK14 (0.56) MAPK14CYP2C9CYP2C19CHRM2
SCHEMBL14109146 0.90 MAPK14 (0.54) MAPK14MLNRCYP3A4CYP2C9CYP2C19
SCHEMBL14109436 0.89 MAPK14 (0.58) MAPK14CYP2C9CYP2C19CHRM2
SCHEMBL14109295 0.87 MAPK14 (0.58) MAPK14CYP2C9CYP2C19CHRM2
SCHEMBL14109144 0.87 MAPK14 (0.71) MAPK14CYP2C9CYP2C19CHRM2
SCHEMBL14109439 0.85 MAPK14 (0.62) MAPK14CYP2C9CYP2C19CHRM2
SCHEMBL14109493 0.85 MAPK14 (0.48) MAPK14MLNRCYP3A4
SCHEMBL4509301 0.85 MAPK14 (0.54) MAPK14MLNRCYP3A4CYP2C9CYP2C19
SCHEMBL13936103 0.85 MAPK14 (0.54) MAPK14MLNRCYP3A4CYP2C9CYP2C19

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-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
US-7244441-B2 Stents and intra-luminal prostheses containing map kinase inhibitors SCIOS, INC. (US) 2007-07-17 US disclosed
US-7244441-B2 Stents and intra-luminal prostheses containing map kinase inhibitors SCIOS, INC. (US) 2007-07-17 US disclosed