SCHEMBL3427765

SCHEMBL3427765

Cc1c(F)cc(C(=O)NC2CC2)cc1-c1ccc(C(=O)NCc2cccc(F)c2)cn1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.71
CYP2C9 P11712 12/20 0.71
MAPK11 Q15759 3/20 0.71
BUB1 O43683 1/20 0.70
PRKACG P22612 1/20 0.70
MAPKAPK2 P49137 1/20 0.70
ACSL5 Q9ULC5 1/20 0.70
STK24 Q9Y6E0 1/20 0.70
ROCK2 O75116 1/20 0.50
ROCK1 Q13464 1/20 0.50
HPGDS O60760 1/20 0.47

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
SCHEMBL3412086 0.93 MAPK14 (0.71) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL30335901 0.92 MAPK14 (0.75) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3405633 0.92 MAPK14 (0.75) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3408667 0.91 MAPK14 (0.70) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL30335517 0.91 MAPK14 (0.70) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3409256 0.90 MAPK14 (0.75) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3411773 0.90 MAPK14 (0.69) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3429853 0.89 MAPK14 (0.74) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3532879 0.89 MAPK14 (0.73) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3404946 0.89 MAPK14 (0.73) MAPK14CYP2C9MAPK11BUB1PRKACG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2258687-B1 Nicotinamide derivates useful as P38 inhibitors GLAXOSMITHKLINE LLC (US) 2012-12-26 EP disclosed
EP-2258687-A1 Nicotinamide derivates useful as P38 inhibitors Glaxosmithkline LLC (US) 2010-12-08 EP disclosed
US-7709506-B2 Nicotinamide derivatives useful as p38 inhibitors GLAXOSMITHKLINE LLC (US) 2010-05-04 US disclosed
EP-1864975-A2 Novel compounds SmithKline Beecham Corporation (US) 2007-12-12 EP disclosed
EP-1474395-B1 NICOTINAMIDE DERIVATES USEFUL AS P38 INHIBITORS SMITHKLINE BEECHAM CORP (US) 2007-10-17 EP disclosed
US-7125898-B2 Nicotinamide derivatives useful as p38 inhibitors. SMITHKLINE BEECHAM CORPORATION (US) 2006-10-24 US disclosed