SCHEMBL30833974

SCHEMBL30833974

CCOCOc1cc(C=C(F)F)ccc1-c1nnc(N[C@@H]2CCCN(C)C2)cc1C

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IL1B P01584 12/20 0.53
NLRP3 Q96P20 12/20 0.53

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
SCHEMBL29030558 0.92 IL1B (0.53) IL1BNLRP3
SCHEMBL29030560 0.92 IL1B (0.53) IL1BNLRP3
SCHEMBL25299226 0.90 IL1B (0.54) IL1BNLRP3
SCHEMBL30488560 0.90 IL1B (0.54) IL1BNLRP3
SCHEMBL25299227 0.90 IL1B (0.54) IL1BNLRP3
SCHEMBL30833978 0.84 IL1B (0.71) IL1BNLRP3
SCHEMBL25257343 0.84 IL1B (0.54) IL1BNLRP3
SCHEMBL25296235 0.84 IL1B (0.54) IL1BNLRP3
SCHEMBL25299192 0.83 IL1B (0.54) IL1BNLRP3
SCHEMBL25299193 0.83 IL1B (0.54) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4613749-A1 NLRP3 INFLAMMASOME INHIBITOR AND USE THEREOF TransThera Sciences (Nanjing), Inc. (CN) 2025-09-10 EP disclosed
CN-117986258-A NLRP3 inflammation corpuscle inhibitor and application thereof 药捷安康(南京)科技股份有限公司 2024-05-07 CN disclosed