SCHEMBL22890867

SCHEMBL22890867

Cc1cc(C#N)c(Cl)nc1C(=O)Nc1ccc2[nH]nc(C)c2c1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 20/20 0.58

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
SCHEMBL29643915 1.00 LRRK2 (0.58) LRRK2
SCHEMBL22890404 0.86 LRRK2 (0.67) LRRK2
SCHEMBL29643991 0.86 LRRK2 (0.67) LRRK2
SCHEMBL22890474 0.83 LRRK2 (0.72) LRRK2
SCHEMBL22890703 0.82 LRRK2 (0.74) LRRK2
SCHEMBL29643860 0.82 LRRK2 (0.74) LRRK2
SCHEMBL22890683 0.81 LRRK2 (0.78) LRRK2
SCHEMBL29644031 0.81 LRRK2 (0.66) LRRK2
SCHEMBL22890870 0.81 LRRK2 (0.66) LRRK2
SCHEMBL22890738 0.80 LRRK2 (0.80) 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-2021007477-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2021-01-14 — — WO disclosed
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