SCHEMBL26435689

SCHEMBL26435689

CN1CCCC(Nc2nnc(-c3ccc(C(F)(F)F)cc3O)c3cccnc23)C1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IL1B P01584 15/20 0.71
NLRP3 Q96P20 9/20 0.67

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
SCHEMBL30039618 1.00 IL1B (0.71) IL1BNLRP3
SCHEMBL26092927 1.00 IL1B (0.71) IL1BNLRP3
SCHEMBL26093606 0.93 IL1B (0.71) IL1BNLRP3
SCHEMBL26435883 0.93 IL1B (0.71) IL1BNLRP3
SCHEMBL30040117 0.93 IL1B (0.71) IL1BNLRP3
SCHEMBL30624633 0.90 IL1B (0.58) IL1BNLRP3
Formic Acid SCHEMBL29275948 0.89 IL1B (0.66) IL1BNLRP3
Formic Acid SCHEMBL30994623 0.89 IL1B (0.66) IL1BNLRP3
SCHEMBL30624889 0.89 IL1B (0.56) IL1BNLRP3
SCHEMBL31072359 0.88 IL1B (0.56) 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