SCHEMBL4704976

SCHEMBL4704976

Cc1ccc(NC(=O)c2ccoc2)cc1-c1ccc(C(=O)NCC2CCN(C(=O)O)C(C(C)(C)C)C2)cc1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.72
HSPB1 P04792 3/20 0.72
MAPK13 O15264 1/20 0.52
MAPK12 P53778 1/20 0.52
MAPK11 Q15759 1/20 0.52
RAF1 P04049 1/20 0.51
LYN P07948 1/20 0.51

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
SCHEMBL4705471 0.88 MAPK14 (0.83) MAPK14HSPB1MAPK13MAPK12MAPK11
SCHEMBL4701715 0.86 MAPK14 (0.72) MAPK14HSPB1RAF1LYN
SCHEMBL4703968 0.86 MAPK14 (0.82) MAPK14HSPB1MAPK13MAPK12MAPK11
Gw743024X SCHEMBL4817886 0.84 MAPK14 (1.00) MAPK14HSPB1
SCHEMBL4701894 0.82 MAPK14 (0.75) MAPK14HSPB1MAPK13MAPK12MAPK11
SCHEMBL4819651 0.75 MAPK14 (0.74) MAPK14HSPB1
SCHEMBL4820944 0.74 MAPK14 (1.00) MAPK14HSPB1
SCHEMBL5641887 0.74 MAPK14 (0.68) MAPK14HSPB1MAPK13MAPK12MAPK11
SCHEMBL4815165 0.74 MAPK14 (1.00) MAPK14HSPB1
SCHEMBL4822166 0.74 MAPK14 (1.00) MAPK14HSPB1

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
EP-1436272-B1 BIPHENYLCARBOXYLIC AMIDE DERIVATIVES AS P38 KINASE INHIBITORS GLAXO GROUP LTD (GB) 2008-05-07 EP claimed