SCHEMBL22014367

SCHEMBL22014367

CNS(=O)(=NC(=O)Cc1cc2c(c3c1CCC3)CCC2)c1cnc(C(C)(C)O)s1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 7/20 0.36
CA2 P00918 1/20 0.32

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
SCHEMBL20698710 0.87 NLRP3 (0.35) NLRP3CA2
SCHEMBL20698924 0.87 NLRP3 (0.35) NLRP3CA2
SCHEMBL30244249 0.81 NLRP3 (0.47) NLRP3CA2
SCHEMBL30244443 0.81 NLRP3 (0.47) NLRP3CA2
SCHEMBL30770383 0.81 NLRP3 (0.47) NLRP3CA2
SCHEMBL20692113 0.81 NLRP3 (0.47) NLRP3CA2
SCHEMBL21810618 0.79 NLRP3 (0.39) NLRP3CA2
SCHEMBL25067084 0.77 NLRP3 (0.36) NLRP3CA2
SCHEMBL25067175 0.77 NLRP3 (0.36) NLRP3CA2
SCHEMBL20698709 0.76 NLRP3 (0.31) NLRP3CA2

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-2020102574-A1 THE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-05-22 WO disclosed