SCHEMBL14642105

SCHEMBL14642105

CNc1nc(Nc2ccc(C(=O)OC)cc2OC(F)F)ncc1CI

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 20/20 0.53

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
SCHEMBL7448853 0.85 LRRK2 (0.70) LRRK2
SCHEMBL7453776 0.77 LRRK2 (0.77) LRRK2
SCHEMBL28261209 0.74 MAPT (0.48) —
SCHEMBL7452819 0.70 LRRK2 (1.00) LRRK2
SCHEMBL7446611 0.69 LRRK2 (0.80) LRRK2
SCHEMBL15003190 0.69 LRRK2 (0.89) LRRK2
SCHEMBL12065527 0.68 LRRK2 (0.81) LRRK2
SCHEMBL7456753 0.68 LRRK2 (0.77) LRRK2
SCHEMBL16839615 0.66 MAPT (0.44) —
SCHEMBL12065535 0.66 LRRK2 (0.77) 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
US-8354420-B2 Aminopyrimidine derivatives as LRRK2 inhibitors GENENTECH, INC. (US) 2013-01-15 — — US disclosed
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