SCHEMBL883601

SCHEMBL883601

Nc1ccc(-c2cc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)ccn2)cc1

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 20/20 0.85

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
SCHEMBL883344 0.92 LRRK2 (1.00) LRRK2
SCHEMBL883604 0.89 LRRK2 (0.77) LRRK2
SCHEMBL13834234 0.87 LRRK2 (1.00) LRRK2
SCHEMBL10225329 0.86 LRRK2 (0.75) LRRK2
SCHEMBL883602 0.86 LRRK2 (1.00) LRRK2
SCHEMBL883607 0.85 LRRK2 (1.00) LRRK2
SCHEMBL883340 0.84 LRRK2 (1.00) LRRK2
SCHEMBL883663 0.84 LRRK2 (1.00) LRRK2
SCHEMBL883589 0.84 LRRK2 (1.00) LRRK2
SCHEMBL10225331 0.83 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-2012038743-A1 PYRAZOLOPYRIDINES AS INHIBITORS OF THE KINASE LRRK2 MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2012-03-29 WO disclosed