SCHEMBL17599401

SCHEMBL17599401

Cc1c(S(=O)(=O)Nc2ccc(-c3cccc(C(=O)O)c3)c3ccccc23)sc2ccc(Cl)cc12

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PFKFB4 Q16877 9/20 0.69
PFKFB3 Q16875 9/20 0.69
KEAP1 Q14145 1/20 0.57
CMA1 P23946 5/20 0.54
NPSR1 Q6W5P4 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HTR6 P50406 1/20 0.49

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
SCHEMBL17613337 0.86 PFKFB3 (0.63) PFKFB4PFKFB3KEAP1CMA1NPSR1
SCHEMBL788108 0.82 PFKFB4 (1.00) PFKFB4PFKFB3CMA1NPSR1L3MBTL1
SCHEMBL27685 0.82 PFKFB4 (0.66) PFKFB4PFKFB3KEAP1CMA1NPSR1
SCHEMBL17599404 0.81 KMT2A (0.48) NPSR1L3MBTL1
SCHEMBL5621524 0.81 PFKFB3 (0.70) PFKFB4PFKFB3KEAP1CMA1NPSR1
SCHEMBL2157918 0.80 PFKFB4 (0.66) PFKFB4PFKFB3KEAP1CMA1NPSR1
Propane SCHEMBL28642185 0.80 PFKFB4 (0.94) PFKFB4PFKFB3CMA1NPSR1L3MBTL1
SCHEMBL17613341 0.79 PFKFB4 (0.46) PFKFB4PFKFB3KEAP1
SCHEMBL2912893 0.79 CMA1 (0.82) PFKFB4PFKFB3CMA1NPSR1L3MBTL1
SCHEMBL17599340 0.79 SLC16A3 (0.58) L3MBTL1

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-2998294-A1 Naphthyl sulfonamide phenyl derivatives as KEAP-1 modulators for the treatment of diabetes, obesity, dyslipidemia and related disorders SANOFI (FR) 2016-03-23 EP disclosed