SCHEMBL20699012

SCHEMBL20699012

CC(C)c1cc(C#N)c(F)c(C(C)C)c1CC(=O)/N=[SH](=O)/C1=NC(C(C)(C)O)CS1

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.43

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
SCHEMBL20699010 0.81 NLRP3 (0.45) NLRP3
SCHEMBL22014352 0.77 NLRP3 (0.47) NLRP3
SCHEMBL25066950 0.77 NLRP3 (0.47) NLRP3
SCHEMBL23692266 0.77 NLRP3 (0.58) NLRP3
SCHEMBL23692320 0.73 NLRP3 (0.43) NLRP3
SCHEMBL23692357 0.72 NLRP3 (0.44) NLRP3
SCHEMBL23692243 0.69 NLRP3 (0.43) NLRP3
SCHEMBL23692111 0.69 NLRP3 (0.36) NLRP3
SCHEMBL20681566 0.69 NLRP3 (0.48) NLRP3
SCHEMBL29687458 0.69 NLRP3 (0.48) 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-2019023145-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY IFM Tre, Inc. (US) 2019-01-31 WO disclosed