SCHEMBL26434286

SCHEMBL26434286

Cc1cc(C(F)(F)F)cc(O)c1-c1nnc(NC2CC(O)C2)nc1C

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IL1B P01584 20/20 0.49
TNF P01375 6/20 0.49

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
SCHEMBL30054414 0.86 IL1B (0.48) IL1BTNF
SCHEMBL29159533 0.86 IL1B (0.48) IL1BTNF
SCHEMBL29159532 0.86 IL1B (0.48) IL1BTNF
SCHEMBL26434272 0.86 IL1B (0.35) IL1BTNF
SCHEMBL26434254 0.85 IL1B (0.36) IL1BTNF
SCHEMBL26434290 0.85 IL1B (0.61) IL1BTNF
SCHEMBL24695701 0.84 NLRP3 (0.54) IL1BTNF
SCHEMBL26437243 0.83 IL1B (0.41) IL1BTNF
SCHEMBL26434250 0.82 IL1B (0.58) IL1BTNF
SCHEMBL26434246 0.81 IL1B (0.74) IL1B

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