SCHEMBL17599530

SCHEMBL17599530

Cc1cc(C)c(C)c(S(=O)(=O)Nc2cc(N3CC[C@H](C(=O)O)C3)cc3ccccc23)c1C

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 7/20 0.73
▸ NFE2L2 Q16236 1/20 0.73
▸ NOTUM Q6P988 10/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ CRHBP P24387 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CRHR2 Q13324 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ EPHX2 P34913 1/20 0.40
▸ GHSR Q92847 1/20 0.38

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
SCHEMBL17599450 0.94 KEAP1 (0.66) KEAP1NFE2L2NOTUMKDM4EMEN1
SCHEMBL17599442 0.85 KEAP1 (1.00) KEAP1NFE2L2NOTUMKDM4EMEN1
SCHEMBL29584677 0.85 KEAP1 (1.00) KEAP1NFE2L2NOTUMKDM4EMEN1
SCHEMBL17599452 0.85 KEAP1 (1.00) KEAP1NFE2L2NOTUMKDM4EMEN1
SCHEMBL17599491 0.85 KEAP1 (1.00) KEAP1NFE2L2NOTUMKDM4EMEN1
SCHEMBL17599548 0.84 NPSR1 (0.53) KEAP1NFE2L2KDM4EMEN1ALDH1A1
SCHEMBL17599553 0.80 KEAP1 (0.49) KEAP1NFE2L2KDM4EMEN1ALDH1A1
SCHEMBL24811433 0.80 KEAP1 (0.89) KEAP1NFE2L2NOTUMKDM4EMEN1
SCHEMBL17599488 0.79 KEAP1 (0.89) KEAP1NFE2L2NOTUMKDM4EMEN1
SCHEMBL17599417 0.79 KEAP1 (0.89) KEAP1NFE2L2NOTUMKDM4EMEN1

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-2998292-A1 Naphthyl sulfonamide derivatives as KEAP-1 modulators for the treatment of diabetes, obesity, dyslipidemia and related disorders SANOFI (FR) 2016-03-23 — — EP claimed
EP-2998292-A1 Naphthyl sulfonamide derivatives as KEAP-1 modulators for the treatment of diabetes, obesity, dyslipidemia and related disorders SANOFI (FR) 2016-03-23 — — EP disclosed
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