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Sugi Predict / Compounds / SCHEMBL5633482

SCHEMBL5633482

SCHEMBL5633482

Cc1ccc(C(=O)NCc2ccc(C(N)=O)cc2)cc1-c1ccc(C(=O)NCC2CC2)cc1.Cc1ccc(C(=O)NCc2ccc(C(N)=O)cc2)cc1-c1ccc(C(=O)NCC2CC2)cc1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 20/20 0.77
▸ MAPK11 Q15759 2/20 0.68
▸ HSPB1 P04792 1/20 0.68
▸ CYP2C9 P11712 1/20 0.68
▸ EPHA3 P29320 1/20 0.57
▸ FRK P42685 1/20 0.57

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
SCHEMBL6748200 1.00 MAPK14 (0.77) MAPK14MAPK11HSPB1CYP2C9EPHA3
SCHEMBL5629906 0.89 MAPK14 (0.80) MAPK14MAPK11HSPB1CYP2C9EPHA3
SCHEMBL5632508 0.88 MAPK14 (1.00) MAPK14MAPK11HSPB1CYP2C9
SCHEMBL5462512 0.85 MAPK14 (0.90) MAPK14MAPK11HSPB1CYP2C9
SCHEMBL5629868 0.82 MAPK14 (0.88) MAPK14MAPK11HSPB1CYP2C9
SCHEMBL6744546 0.81 MAPK14 (1.00) MAPK14MAPK11HSPB1CYP2C9
SCHEMBL6620463 0.81 MAPK14 (1.00) MAPK14MAPK11HSPB1CYP2C9
SCHEMBL4814641 0.81 MAPK14 (0.81) MAPK14MAPK11HSPB1CYP2C9
Gw782912X SCHEMBL6747431 0.79 MAPK14 (1.00) MAPK14MAPK11HSPB1CYP2C9
Gw782912X SCHEMBL5632189 0.79 MAPK14 (1.00) MAPK14MAPK11HSPB1CYP2C9

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