SCHEMBL5630409

SCHEMBL5630409

Cc1ccc(C(=O)NC2CC2)cc1-c1ccc(C(=O)NCC2CC2)cc1F.O=C(NCC1CC1)c1ccc(Br)c(F)c1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.66
CYP2C9 P11712 4/20 0.66
MAPK11 Q15759 2/20 0.66
HSPB1 P04792 1/20 0.66

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
SCHEMBL5631398 0.94 MAPK14 (0.74) MAPK14CYP2C9MAPK11HSPB1
SCHEMBL5632201 0.84 MAPK14 (0.79) MAPK14CYP2C9MAPK11HSPB1
SCHEMBL5632191 0.82 MAPK14 (0.55) MAPK14CYP2C9MAPK11
SCHEMBL6744546 0.80 MAPK14 (1.00) MAPK14CYP2C9MAPK11HSPB1
SCHEMBL13715287 0.79 MAPK14 (0.77) MAPK14CYP2C9MAPK11HSPB1
SCHEMBL5631551 0.78 MAPK14 (0.75) MAPK14CYP2C9MAPK11HSPB1
SCHEMBL5630113 0.78 MAPK14 (0.89) MAPK14CYP2C9MAPK11HSPB1
SCHEMBL5633653 0.77 MAPK14 (0.67) MAPK14CYP2C9MAPK11HSPB1
SCHEMBL5631004 0.76 MAPK14 (1.00) MAPK14CYP2C9MAPK11HSPB1
Gw782912X SCHEMBL6747431 0.76 MAPK14 (1.00) MAPK14CYP2C9MAPK11HSPB1

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-7208629-B2 5′-Carbamoyl-1,1-biphenyl-4-carboxamide derivatives and their use as p38 kinase inhibitors GLAXO GROUP LIMITED (GB) 2007-04-24 US disclosed