SCHEMBL25798976

SCHEMBL25798976

CN1CCC[C@@H](Nc2nnc(-c3ccc(Cl)cc3)cc2C(F)(F)F)C1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IL1B P01584 16/20 0.61
NLRP3 Q96P20 7/20 0.46
MALT1 Q9UDY8 1/20 0.42
ACHE P22303 1/20 0.41

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
SCHEMBL25798588 0.91 IL1B (0.62) IL1BNLRP3
SCHEMBL25798270 0.91 IL1B (0.65) IL1BNLRP3
SCHEMBL25798372 0.91 IL1B (0.68) IL1BNLRP3
SCHEMBL25798524 0.85 IL1B (0.59) IL1BNLRP3MALT1ACHE
SCHEMBL22655109 0.83 IL1B (0.60) IL1BNLRP3
SCHEMBL22655107 0.83 IL1B (0.60) IL1BNLRP3
SCHEMBL25797975 0.83 IL1B (0.61) IL1BNLRP3
SCHEMBL25798368 0.82 IL1B (0.62) IL1BNLRP3
SCHEMBL25798316 0.80 IL1B (0.65) IL1BNLRP3
SCHEMBL25798818 0.80 IL1B (0.70) 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-2023129987-A1 PYRIDAZINE DERIVATIVES AS MODULATORS OF NLRP3 INFLAMMASOME AND RELATED METHODS Neumora Therapeutics, Inc. (US) 2023-07-06 WO disclosed