SCHEMBL883174

SCHEMBL883174

CC(C(=O)N1CCN(C)CC1)C(C)c1n[nH]c2ccnc(OC3CCOCC3)c12

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 20/20 0.54

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
SCHEMBL13975602 0.83 LRRK2 (0.51) LRRK2
SCHEMBL883235 0.77 LRRK2 (0.54) LRRK2
SCHEMBL382305 0.70 LRRK2 (0.67) LRRK2
SCHEMBL883298 0.70 LRRK2 (1.00) LRRK2
SCHEMBL13834221 0.69 LRRK2 (0.53) LRRK2
SCHEMBL883255 0.69 LRRK2 (1.00) LRRK2
SCHEMBL883317 0.69 LRRK2 (1.00) LRRK2
SCHEMBL883172 0.69 LRRK2 (0.60) LRRK2
SCHEMBL883597 0.68 LRRK2 (1.00) LRRK2
SCHEMBL883640 0.68 LRRK2 (0.97) 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