SCHEMBL22908355

SCHEMBL22908355

CCCOc1ccc(Cl)cc1CN(CCc1ccc(S(=O)(=O)NCc2ccc(OC)cc2)cc1)C(=O)Cc1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.55

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
SCHEMBL22908324 0.95
SCHEMBL22908360 0.95
SCHEMBL22908323 0.92
SCHEMBL22908353 0.92 ALDH1A1 (0.51)
SCHEMBL22908336 0.90
SCHEMBL22908330 0.90
SCHEMBL22908334 0.89 NLRP3 (0.70) NLRP3
SCHEMBL22908329 0.87 NLRP3 (0.72) NLRP3
SCHEMBL22908335 0.86 NLRP3 (0.46) NLRP3
SCHEMBL22908366 0.86 NLRP3 (0.57) NLRP3

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-2021011592-A1 COMPOUNDS AS NLRP3 INFLAMMASOME INHIBITORS AND COMPOSITIONS AND USES THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 2021-01-21 WO disclosed