SCHEMBL25798827

SCHEMBL25798827

Cc1cc(-c2ccc(Cl)cc2C#N)nnc1N[C@@H]1CCCN(C)C1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IL1B P01584 13/20 0.59
▸ NLRP3 Q96P20 9/20 0.46
▸ LRRK2 Q5S007 1/20 0.40

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
SCHEMBL25798179 0.90 IL1B (0.61) IL1BNLRP3LRRK2
SCHEMBL25798328 0.89 IL1B (0.63) IL1BNLRP3LRRK2
SCHEMBL25798443 0.88 IL1B (0.66) IL1BNLRP3
SCHEMBL25798267 0.87 IL1B (0.60) IL1BNLRP3LRRK2
SCHEMBL26772291 0.87 IL1B (0.73) IL1BNLRP3
SCHEMBL25802975 0.86 IL1B (0.78) IL1BNLRP3
SCHEMBL25798591 0.85 IL1B (0.65) IL1BNLRP3
SCHEMBL25798834 0.83 IL1B (0.66) IL1BNLRP3
SCHEMBL26773994 0.82 IL1B (0.69) IL1BNLRP3LRRK2
SCHEMBL25798524 0.81 IL1B (0.59) 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
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