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SCHEMBL2661871

SCHEMBL2661871

Cc1ccc(NC(=O)Nc2ncc(CS(=O)(=O)c3nnc[nH]3)s2)c(OCC(C)C)c1.Cc1ccc(NC(=O)Nc2ncc(CS(=O)(=O)c3nnnn3C)s2)c(OCC(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 13/20 0.34
▸ MAPK13 O15264 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL1343558 0.92 MAPK14 (0.35) MAPK14MAPK13LMNATSHRMEN1
SCHEMBL1342850 0.92 MAPK14 (0.35) MAPK14MAPK13
SCHEMBL10002659 0.90 MAPK14 (0.33) MAPK14MAPK13MEN1KMT2AHSD17B10
SCHEMBL1342155 0.82 MAPT (0.34) MAPK14MAPK13MEN1KMT2AHSD17B10
SCHEMBL1343121 0.82 MAPK14 (0.34) MAPK14MAPK13MEN1KMT2AHSD17B10
SCHEMBL1340670 0.82 MAPK14 (0.33) MAPK14MAPK13MEN1KMT2AHSD17B10
SCHEMBL1341683 0.80 LPAR1 (0.34) MAPK14MAPK13
SCHEMBL1342708 0.80 MAPK14 (0.36) MAPK14MAPK13
SCHEMBL10002709 0.80 LMNA (0.41) LMNATSHRMEN1KMT2AHSD17B10
SCHEMBL2662638 0.80 MAPK14 (0.32) MAPK14MAPK13MEN1KMT2AHSD17B10

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