SCHEMBL379829

SCHEMBL379829

Cc1ccc(C(=O)NC2CC2)cc1-c1ccn2c(N3CCCCC3)nnc2c1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 18/20 0.70
RAF1 P04049 1/20 0.69
MAPK14 Q16539 1/20 0.65
RIPK2 O43353 1/20 0.52

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
SCHEMBL379717 0.99 MAPK13 (0.72) MAPK13RAF1MAPK14RIPK2
SCHEMBL379848 0.91 MAPK13 (0.73) MAPK13RAF1MAPK14RIPK2
SCHEMBL380014 0.84 MAPK13 (0.94) MAPK13RAF1MAPK14
SCHEMBL380900 0.84 MAPK13 (0.66) MAPK13RAF1MAPK14RIPK2
SCHEMBL379661 0.83 MAPK13 (0.76) MAPK13RAF1MAPK14
SCHEMBL380252 0.83 MAPK13 (0.96) MAPK13RAF1MAPK14
SCHEMBL3616014 0.83 MAPK13 (1.00) MAPK13RAF1MAPK14
SCHEMBL379884 0.82 MAPK13 (1.00) MAPK13RAF1MAPK14
SCHEMBL379524 0.82 MAPK13 (0.76) MAPK13RAF1MAPK14
SCHEMBL380693 0.82 MAPK13 (1.00) MAPK13RAF1MAPK14

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