SCHEMBL883213

SCHEMBL883213

C(=C/c1n[nH]c2ccnc(OC3CCCCC3)c12)\c1cn[nH]c1

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 20/20 0.49

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
SCHEMBL883611 0.82 LRRK2 (0.72) LRRK2
SCHEMBL13834181 0.82 LRRK2 (0.72) LRRK2
SCHEMBL3766198 0.78 LRRK2 (0.48) LRRK2
SCHEMBL3766207 0.78 LRRK2 (0.48) LRRK2
SCHEMBL883605 0.75 LRRK2 (0.48) LRRK2
SCHEMBL876184 0.74 LRRK2 (0.62) LRRK2
SCHEMBL382602 0.72 LRRK2 (0.65) LRRK2
SCHEMBL3770348 0.72 LRRK2 (0.58) LRRK2
SCHEMBL3769191 0.72 LRRK2 (0.65) LRRK2
SCHEMBL883157 0.72 LRRK2 (0.58) 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