SCHEMBL14059769

SCHEMBL14059769

N#Cc1nnc2cc(-c3ccccc3)ccc2c1NCCC1CC1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 7/20 0.46
▸ ACHE P22303 7/20 0.37
▸ EGLN2 Q96KS0 1/20 0.35
▸ EGLN1 Q9GZT9 1/20 0.35
▸ BCHE P06276 4/20 0.35
▸ TRIM58 Q8NG06 1/20 0.35
▸ GBA1 P04062 1/20 0.34

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
SCHEMBL14059647 0.90 LRRK2 (0.46) LRRK2
SCHEMBL14059181 0.90 LRRK2 (0.46) LRRK2
SCHEMBL14059259 0.87 LRRK2 (0.46) LRRK2
SCHEMBL14059133 0.85 LRRK2 (0.55) LRRK2
SCHEMBL14059477 0.85 LRRK2 (0.46) LRRK2
SCHEMBL14059793 0.83 LRRK2 (0.48) LRRK2
SCHEMBL14059025 0.83 LRRK2 (0.47) LRRK2
SCHEMBL14060226 0.83 LRRK2 (0.44) LRRK2
SCHEMBL14059470 0.83 FYN (0.42) LRRK2
SCHEMBL14059866 0.82 LRRK2 (0.48) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2726465-A1 INHIBITORS OF LRRK2 KINASE ACTIVITY Elan Pharmaceuticals Inc. (US) 2014-05-07 — — EP disclosed
WO-2012162254-A1 INHIBITORS OF LRRK2 KINASE ACTIVITY ELAN PHARMACEUTICALS, INC. (US) 2012-11-29 — — WO disclosed
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