SCHEMBL25864814

SCHEMBL25864814

C#Cc1ccc(-c2nnc(N)cc2C2CC2)c(O)c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 2/20 0.31
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30

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
SCHEMBL25856423 0.85 NLRP3 (0.30) NLRP3
SCHEMBL25859845 0.81 NLRP3 (0.36) NLRP3
SCHEMBL25862580 0.79 USP7 (0.32) NLRP3
SCHEMBL25856342 0.79 USP7 (0.32) NLRP3
SCHEMBL31314320 0.79
SCHEMBL31314231 0.78 NLRP3 (0.34) NLRP3
SCHEMBL25856432 0.78 NLRP3 (0.38) NLRP3
SCHEMBL31314309 0.77
SCHEMBL25858367 0.77
SCHEMBL31314321 0.77 NLRP3 (0.32) 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-2023131277-A1 NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF 药捷安康(南京)科技股份有限公司 2023-07-13 WO disclosed