SCHEMBL2649899

SCHEMBL2649899

Cc1ccc(NC(=O)Nc2ncc(CCc3nc(C(=O)ON(C(=O)Nc4ncc(Cc5nc6ncccc6o5)s4)c4ccc(C)cc4N4CCCCC4)c(C(F)(F)F)o3)s2)c(N2CCCCC2)c1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.33
PLK1 P53350 1/20 0.32
MAPK13 O15264 5/20 0.31

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
SCHEMBL2649897 0.89 PLK1 (0.36) MAPK14PLK1MAPK13
SCHEMBL1342443 0.82 POLB (0.39) MAPK14
SCHEMBL1343783 0.80 PLK1 (0.41) MAPK14PLK1MAPK13
SCHEMBL2650977 0.74 MAPK14 (0.36) MAPK14MAPK13
SCHEMBL1344050 0.73 NPSR1 (0.43)
SCHEMBL1343546 0.72 MAPK14 (0.39) MAPK14MAPK13
SCHEMBL2651299 0.70 POLB (0.40) MAPK14PLK1MAPK13
SCHEMBL1342898 0.70 MAPK14 (0.38) MAPK14MAPK13
SCHEMBL1343567 0.69 POLB (0.38)
SCHEMBL1340704 0.69 POLB (0.41) MAPK14PLK1MAPK13

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-1531815-A1 GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2005-05-25 EP disclosed
WO-2004002481-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2004-01-08 WO disclosed