SCHEMBL31055702

SCHEMBL31055702

CC1CCN(S(=O)(=O)NC(=O)Nc2c(C(C)C)cc(F)cc2C(C)C)CC1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KCNT1 Q5JUK3 3/20 0.41
▸ GSTO1 P78417 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ NLRP3 Q96P20 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
SCHEMBL31055704 0.91 GSTO1 (0.39) GSTO1GAANLRP3
SCHEMBL26975370 0.89 NLRP3 (0.43) KCNT1GAANLRP3
SCHEMBL31055707 0.88 NLRP3 (0.47) KCNT1GAANLRP3
SCHEMBL22460322 0.87 GAA (0.52) GSTO1GAANLRP3
SCHEMBL26975371 0.86 NLRP3 (0.51) NLRP3
SCHEMBL22460158 0.85 GSTO1 (0.41) GSTO1GAAALDH1A1TSHRNLRP3
SCHEMBL31055720 0.85 GAA (0.39) GSTO1GAANLRP3
SCHEMBL31055722 0.85 ACHE (0.41) GSTO1GAANLRP3
SCHEMBL31055725 0.84 GSTO1 (0.39) GSTO1NLRP3
SCHEMBL31055694 0.84 MEN1 (0.39) GSTO1GAAALDH1A1NLRP3

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-3416948-B1 INDACENE BEARING SULFONYLUREAS AS ANTI-INFLAMMATORY AGENTS UNIV QUEENSLAND (AU) 2024-07-24 — — EP claimed
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