SCHEMBL1846136

SCHEMBL1846136

CN(C=O)c1cccc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)n[nH]3)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.46
RAF1 P04049 13/20 0.45
MAPK13 O15264 2/20 0.42
MAPK12 P53778 1/20 0.42
MAPK11 Q15759 1/20 0.42
MTNR1B P49286 1/20 0.40

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
SCHEMBL5575760 0.84 MAPK14 (0.61) MAPK14RAF1MAPK13MAPK12MAPK11
SCHEMBL668648 0.81 MAPK14 (0.61) MAPK14RAF1MAPK13MAPK12MAPK11
SCHEMBL1396018 0.81 RAF1 (0.63) MAPK14RAF1MAPK13
SCHEMBL1846138 0.79 MAPK14 (0.49) MAPK14RAF1MAPK13MAPK12MAPK11
SCHEMBL668382 0.79 RAF1 (0.62) MAPK14RAF1MAPK13
SCHEMBL1846789 0.79 RAF1 (0.71) MAPK14RAF1MAPK13MAPK12MAPK11
SCHEMBL1846781 0.78 RAF1 (0.63) MAPK14RAF1MAPK13MAPK12MAPK11
SCHEMBL667815 0.77 RAF1 (0.60) MAPK14RAF1MAPK13
SCHEMBL939302 0.75 MAPK14 (0.49) MAPK14RAF1MAPK13
SCHEMBL2083949 0.74 GRM5 (0.48) MAPK14RAF1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2324825-A1 Aryl ureas with angiogenesis inhibiting activity Bayer Healthcare LLC (US) 2011-05-25 EP claimed
EP-2324825-A1 Aryl ureas with angiogenesis inhibiting activity Bayer Healthcare LLC (US) 2011-05-25 EP disclosed