SCHEMBL19290474

SCHEMBL19290474

Cn1cc(-c2cc3c(-c4cc(N5CCCn6ncnc6C5)ncn4)n[nH]c3cc2F)cn1

nearest known ligand 0.91

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 20/20 0.91

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
SCHEMBL16024803 0.95 LRRK2 (1.00) LRRK2
SCHEMBL16023111 0.84 LRRK2 (1.00) LRRK2
SCHEMBL17427435 0.83 LRRK2 (1.00) LRRK2
SCHEMBL16023075 0.83 LRRK2 (1.00) LRRK2
SCHEMBL16023349 0.82 LRRK2 (1.00) LRRK2
SCHEMBL16023333 0.81 LRRK2 (1.00) LRRK2
SCHEMBL16023129 0.81 LRRK2 (0.75) LRRK2
SCHEMBL16023332 0.81 LRRK2 (1.00) LRRK2
SCHEMBL16023117 0.81 LRRK2 (1.00) LRRK2
SCHEMBL16023342 0.81 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
EP-2964222-B1 COMPOUNDS INHIBITING LEUCINE-RICH REPEAT KINASE ENZYME ACTIVITY MERCK SHARP & DOHME (US) 2017-08-30 — — EP disclosed
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