SCHEMBL23935006

SCHEMBL23935006

CC(C)c1cn(Cc2nc3cnc4ccc(C#N)cc4c3n2C2CCO[C@H](C)C2)nn1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 20/20 0.73

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
SCHEMBL18634668 1.00 LRRK2 (0.73) LRRK2
SCHEMBL18606417 0.90 LRRK2 (0.76) LRRK2
SCHEMBL18634359 0.89 LRRK2 (0.74) LRRK2
SCHEMBL18634536 0.87 LRRK2 (0.73) LRRK2
SCHEMBL18634529 0.85 LRRK2 (0.72) LRRK2
SCHEMBL18634361 0.85 LRRK2 (0.82) LRRK2
SCHEMBL24027303 0.84 LRRK2 (1.00) LRRK2
SCHEMBL30154565 0.84 LRRK2 (1.00) LRRK2
SCHEMBL26802804 0.83 LRRK2 (0.75) LRRK2
SCHEMBL18634404 0.83 LRRK2 (0.74) LRRK2

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
EP-3350178-B1 NOVEL IMIDAZO [4,5-C]QUINOLINE AND IMIDAZO [4,5-C][1,5]NAPHTHYRIDINE DERIVATIVES AS LRRK2 INHIBITORS PFIZER (US) 2021-10-20 EP disclosed