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SCHEMBL2648841

SCHEMBL2648841

Cc1ccc(NC(=O)Nc2ncc(CCCC(=O)ON(C(=O)Nc3ncc(CCc4ncno4)s3)c3ccc(C)cc3C(=O)C3CCCC3)s2)c(C(=O)C2CCCC2)c1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 12/20 0.34
▸ MAPK13 O15264 5/20 0.34

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
SCHEMBL2648838 0.87 MAPK14 (0.37) MAPK14MAPK13
SCHEMBL1341597 0.86 MAPK14 (0.41) MAPK14MAPK13
SCHEMBL1342802 0.81 SMN1; SMN2 (0.42) MAPK14MAPK13
SCHEMBL1341599 0.78 MAPK14 (0.40) MAPK14MAPK13
SCHEMBL1339818 0.75 SMN1; SMN2 (0.40) MAPK14MAPK13
SCHEMBL4470766 0.74 SMN1; SMN2 (0.40) MAPK14MAPK13
SCHEMBL1343218 0.74 MAPK14 (0.40) MAPK14MAPK13
SCHEMBL1342702 0.73 MAPK14 (0.40) MAPK14MAPK13
SCHEMBL1343592 0.72 MAPK14 (0.40) MAPK14MAPK13
SCHEMBL1342806 0.72 MAPK14 (0.40) MAPK14MAPK13

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