SCHEMBL18658802

SCHEMBL18658802

Cc1cnn(Cc2nc3cnc4ccc(F)cc4c3n2C2CCO[C@H](C)C2)c1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 20/20 0.66

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
SCHEMBL18623747 1.00 LRRK2 (0.66) LRRK2
SCHEMBL18623752 0.90 LRRK2 (0.70) LRRK2
SCHEMBL18623734 0.90 LRRK2 (0.82) LRRK2
SCHEMBL18634361 0.88 LRRK2 (0.82) LRRK2
SCHEMBL18623748 0.88 LRRK2 (0.81) LRRK2
SCHEMBL18658931 0.83 LRRK2 (0.80) LRRK2
SCHEMBL18623749 0.83 LRRK2 (0.80) LRRK2
SCHEMBL18658930 0.82 LRRK2 (0.65) LRRK2
SCHEMBL18606322 0.80 LRRK2 (0.79) LRRK2
SCHEMBL24027231 0.80 LRRK2 (1.00) 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
WO-2017046675-A1 NOVEL IMIDAZO [4,5-C] QUINOLINE AND IMIDAZO [4,5-C][1,5] NAPHTHYRIDINE DERIVATIVES AS LRRK2 INHIBITORS PFIZER INC. (US) 2017-03-23 WO disclosed