SCHEMBL2215688

SCHEMBL2215688

Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(OC(=O)NCc2ccc(F)cc2)c1N

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.48
MAPK11 Q15759 3/20 0.47
CYP3A4 P08684 1/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LCK P06239 1/20 0.42
KIT P10721 1/20 0.42
KDR P35968 1/20 0.42
MAPKAPK2 P49137 1/20 0.42

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
SCHEMBL2214347 0.92 MAPK14 (0.52) MAPK14MAPK11
SCHEMBL2214745 0.89 MAPK14 (0.44) MAPK14MAPK11LMNASMN1; SMN2
SCHEMBL1417139 0.86 MAPK14 (0.63) MAPK14MAPK11LMNAHTTSMN1; SMN2
SCHEMBL2217376 0.86 MAPK14 (0.45) MAPK14MAPK11LMNASMN1; SMN2
SCHEMBL2216010 0.86 PSEN1 (0.43) MAPK14MAPK11
SCHEMBL2213705 0.86 MAPK14 (0.52) MAPK14MAPK11CYP3A4KIT
SCHEMBL2216554 0.86 MAPK14 (0.47) MAPK14MAPK11LMNALCKKIT
SCHEMBL2214420 0.86 MAPK14 (0.56) MAPK14MAPK11
SCHEMBL2215757 0.85 MAPK14 (0.46) MAPK14MAPK11CYP3A4MAPKAPK2
SCHEMBL2218498 0.84 MAPK14 (0.46) MAPK14MAPK11

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-1641764-B1 5-MEMBERED HETEROCYCLE-BASED P38 KINASE INHIBITORS NOVARTIS AG (CH) 2011-07-27 EP claimed