SCHEMBL23934976

SCHEMBL23934976

C[C@@H]1CC(n2c(CN/C=N\C=N)nc3cnc4ccc(C#N)cc4c32)CCO1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 20/20 0.65

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
SCHEMBL23935125 0.91 LRRK2 (0.63) LRRK2
SCHEMBL23935074 0.89 LRRK2 (0.64) LRRK2
SCHEMBL18658915 0.87 LRRK2 (0.65) LRRK2
SCHEMBL23935203 0.86 LRRK2 (0.63) LRRK2
SCHEMBL18659041 0.86 LRRK2 (0.62) LRRK2
SCHEMBL23935002 0.84 LRRK2 (0.63) LRRK2
SCHEMBL26802781 0.84 LRRK2 (0.70) LRRK2
SCHEMBL26802804 0.84 LRRK2 (0.75) LRRK2
SCHEMBL18634666 0.83 LRRK2 (0.73) LRRK2
SCHEMBL26805531 0.83 LRRK2 (0.73) 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