SCHEMBL380231

SCHEMBL380231

Cc1ccc(C(=O)NC2CC2)cc1-c1ccn2c(-c3cccc(S(C)(=O)=O)c3)nnc2c1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.71
MAPK13 O15264 18/20 0.68
RAF1 P04049 1/20 0.65
RIPK2 O43353 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
SCHEMBL379707 0.90 MAPK13 (0.71) MAPK14MAPK13RAF1RIPK2
SCHEMBL379666 0.88 MAPK13 (0.79) MAPK14MAPK13RAF1RIPK2
SCHEMBL380167 0.86 MAPK13 (0.77) MAPK14MAPK13RAF1RIPK2
SCHEMBL380265 0.85 MAPK13 (0.76) MAPK14MAPK13RAF1RIPK2
SCHEMBL379826 0.84 MAPK13 (0.86) MAPK14MAPK13RAF1RIPK2
SCHEMBL379990 0.83 MAPK14 (1.00) MAPK14MAPK13RAF1
SCHEMBL380640 0.83 MAPK13 (0.83) MAPK14MAPK13RAF1
SCHEMBL3619702 0.83 MAPK13 (0.73) MAPK14MAPK13RAF1RIPK2
SCHEMBL379801 0.82 MAPK13 (0.76) MAPK14MAPK13RAF1
SCHEMBL3616016 0.82 MAPK13 (0.74) MAPK14MAPK13RAF1

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-2086973-B1 IMIDAZO- AND TRIAZOLO-PYRIDINE COMPOUNDS AND METHODS OF USE THEROF AMGEN INC (US) 2012-01-25 EP disclosed