SCHEMBL29539657

SCHEMBL29539657

C#CCN(c1ccc(NS(=O)(=O)c2c(C)cc(OC)cc2C)c2ccccc12)[C@@H](C)CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 20/20 0.45
▸ NFE2L2 Q16236 9/20 0.45
▸ SQSTM1 Q13501 1/20 0.37

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
SCHEMBL24299824 1.00 KEAP1 (0.45) KEAP1NFE2L2SQSTM1
SCHEMBL22922540 0.93 KEAP1 (0.42) KEAP1NFE2L2SQSTM1
SCHEMBL26357056 0.91 KEAP1 (0.48) KEAP1NFE2L2
SCHEMBL26357227 0.89 NMT1 (0.42) KEAP1NFE2L2
SCHEMBL29539842 0.89 NMT1 (0.42) KEAP1NFE2L2
SCHEMBL28407007 0.88 KEAP1 (0.45) KEAP1NFE2L2
SCHEMBL25057908 0.88 KEAP1 (0.45) KEAP1NFE2L2
SCHEMBL26356238 0.87 KEAP1 (0.60) KEAP1NFE2L2SQSTM1
SCHEMBL29732411 0.86 KEAP1 (0.41) KEAP1NFE2L2
SCHEMBL29539949 0.86 KEAP1 (0.56) KEAP1NFE2L2SQSTM1

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-3978471-B1 NAPHTHALENESULFONAMIDE COMPOUND, PREPARATION METHOD, AND APPLICATION UNIV CHINA PHARMA (CN) 2023-02-22 — — EP disclosed
EP-3978471-A1 NAPHTHALENESULFONAMIDE COMPOUND, PREPARATION METHOD, AND APPLICATION China Pharmaceutical University (CN) 2022-04-06 — — EP disclosed
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