SCHEMBL17599512

SCHEMBL17599512

Cc1nn(C)c(C)c1S(=O)(=O)Nc1ccc(N2CC[C@@H](C(=O)O)C2)c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 8/20 0.71
▸ NFE2L2 Q16236 1/20 0.71
▸ TSHR P16473 1/20 0.42
▸ NOTUM Q6P988 4/20 0.42
▸ LMNA P02545 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ GAA P10253 1/20 0.40
▸ FPR2 P25090 1/20 0.39
▸ PROKR1 Q8TCW9 1/20 0.39

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
SCHEMBL17599511 1.00 KEAP1 (0.71) KEAP1NFE2L2TSHRNOTUMLMNA
SCHEMBL17599427 0.91 KEAP1 (0.71) KEAP1NFE2L2NOTUM
SCHEMBL17599484 0.90 KEAP1 (0.70) KEAP1NFE2L2NOTUMLMNAMAPK1
SCHEMBL17599422 0.90 KEAP1 (0.70) KEAP1NFE2L2NOTUMLMNAMAPK1
SCHEMBL17612896 0.86 KEAP1 (0.62) KEAP1NFE2L2NOTUMLMNAMAPK1
SCHEMBL17599508 0.86 KEAP1 (0.62) KEAP1NFE2L2NOTUMLMNAMAPK1
SCHEMBL24812743 0.86 KEAP1 (0.87) KEAP1NFE2L2NOTUM
SCHEMBL17599424 0.84 KEAP1 (0.72) KEAP1NFE2L2NOTUM
SCHEMBL17599452 0.83 KEAP1 (1.00) KEAP1NFE2L2NOTUMLMNA
SCHEMBL17599442 0.83 KEAP1 (1.00) KEAP1NFE2L2NOTUMLMNA

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-2997966-A1 Naphthyl Sulfonamide Pyrrolidine Derivatives as KEAP-1 Modulators for the Treatment of Diabetes, Obesity, Dyslipidemia and Related Disorders SANOFI (FR) 2016-03-23 — — EP claimed
EP-2997966-A1 Naphthyl Sulfonamide Pyrrolidine 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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