SCHEMBL23950506

SCHEMBL23950506

CC(C)c1nn(CC(=O)Nc2ccc3nncn3c2)c(=O)c2c(N)c(C3CC3)nn12

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 19/20 0.61
FPR1 P21462 1/20 0.35
FPR2 P25090 1/20 0.35

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
SCHEMBL25754229 0.97 NLRP3 (0.59) NLRP3FPR1FPR2
SCHEMBL23950192 0.91 NLRP3 (0.60) NLRP3
SCHEMBL25752994 0.90 NLRP3 (0.61) NLRP3
SCHEMBL25754220 0.85 NLRP3 (0.56) NLRP3FPR1FPR2
SCHEMBL23950609 0.83 NLRP3 (0.72) NLRP3
SCHEMBL23950600 0.79 NLRP3 (0.79) NLRP3FPR1FPR2
SCHEMBL23950989 0.78 NLRP3 (0.78) NLRP3
SCHEMBL24077077 0.77 NLRP3 (0.66) NLRP3
SCHEMBL23950413 0.77 NLRP3 (0.79) NLRP3
SCHEMBL25427169 0.77 NLRP3 (0.65) 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-2021209552-A1 PYRAZOLO[1,5-D][1,2,4]TRIAZINE-5(4H)-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY JANSSEN PHARMACEUTICA NV (BE) 2021-10-21 WO disclosed