SCHEMBL26434719

SCHEMBL26434719

Cc1cc(Cl)cc(O)c1-c1ncc(NC2CCCN(C)C2)nn1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IL1B P01584 17/20 0.61
NLRP3 Q96P20 9/20 0.61

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
SCHEMBL26434706 0.92 IL1B (0.70) IL1BNLRP3
SCHEMBL26434710 0.88 IL1B (0.72) IL1BNLRP3
SCHEMBL26093299 0.85 IL1B (0.68) IL1BNLRP3
SCHEMBL26093296 0.85 IL1B (0.68) IL1BNLRP3
SCHEMBL30374765 0.85 IL1B (0.68) IL1BNLRP3
SCHEMBL26434872 0.84 IL1B (0.49) IL1BNLRP3
SCHEMBL26434830 0.84 IL1B (0.44) IL1BNLRP3
SCHEMBL26434847 0.84 NLRP3 (0.45) IL1BNLRP3
SCHEMBL26434860 0.83 NLRP3 (0.45) IL1BNLRP3
SCHEMBL30374745 0.80 IL1B (0.57) IL1BNLRP3

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-2023066377-A1 NITROGEN-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 索智生物科技(浙江)有限公司 2023-04-27 WO disclosed