SCHEMBL25856342

SCHEMBL25856342

C#Cc1ccc(-c2nnc(N)c(C3CC3)c2C2CC2)c(O)c1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 1/20 0.32
NLRP3 Q96P20 2/20 0.31

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
SCHEMBL25862580 1.00 USP7 (0.32) USP7NLRP3
SCHEMBL25858493 0.85 BACE1 (0.33) USP7NLRP3
SCHEMBL25858389 0.81 NLRP3 (0.36) NLRP3
SCHEMBL25864814 0.79 NLRP3 (0.31) NLRP3
SCHEMBL25858470 0.77 GABRA1 (0.30)
SCHEMBL25854477 0.75 NLRP3 (0.43) NLRP3
SCHEMBL25854620 0.74 NLRP3 (0.56) NLRP3
SCHEMBL25854476 0.74 KDM4E (0.43)
SCHEMBL25301015 0.73 CHEK2 (0.41) NLRP3
SCHEMBL25301014 0.73 CHEK2 (0.41) 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