SCHEMBL20634989

SCHEMBL20634989

CC(C)c1cc(F)cc(C(C)CCC(C)c2cccc(C(C)C)c2NC(=O)NS(=O)(=O)C2CN(CC(F)(F)F)C2=O)c1NC(=O)NS(=O)(=O)C1CN(C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GSTO1 P78417 1/20 0.39
▸ NLRP3 Q96P20 3/20 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
SCHEMBL20634988 0.88 GSTO1 (0.36) GSTO1NLRP3
SCHEMBL22433443 0.87 — —
SCHEMBL20635005 0.82 NLRP3 (0.39) GSTO1NLRP3
SCHEMBL22433305 0.82 GSTO1 (0.39) GSTO1NLRP3
SCHEMBL20634985 0.80 NLRP3 (0.50) NLRP3
SCHEMBL20636116 0.80 GSTO1 (0.41) GSTO1NLRP3
SCHEMBL20634990 0.80 NLRP3 (0.43) GSTO1NLRP3
SCHEMBL20636107 0.79 GSTO1 (0.35) GSTO1NLRP3
SCHEMBL20636092 0.78 MEN1 (0.44) —
SCHEMBL20635003 0.78 PER2 (0.34) GSTO1NLRP3

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
WO-2019008025-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS INFLAZOME LIMITED (IE) 2019-01-10 — — WO disclosed
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