SCHEMBL29643913

SCHEMBL29643913

Cc1c(C#N)cnc(C(=O)Nc2ccc3c(c2)c(I)nn3C2CCCCO2)c1C

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
SCHEMBL22890265 1.00 LRRK2 (0.53) LRRK2
SCHEMBL29644045 0.89 LRRK2 (0.56) LRRK2
SCHEMBL22890810 0.89 LRRK2 (0.56) LRRK2
SCHEMBL22890842 0.89 LRRK2 (0.57) LRRK2
SCHEMBL29644098 0.89 LRRK2 (0.57) LRRK2
SCHEMBL22890782 0.88 LRRK2 (0.53) LRRK2
SCHEMBL29643975 0.88 LRRK2 (0.53) LRRK2
SCHEMBL22890694 0.87 LRRK2 (0.55) LRRK2
SCHEMBL29644035 0.87 LRRK2 (0.55) LRRK2
SCHEMBL22890590 0.86 LRRK2 (0.57) 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-3997081-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS Escape Bio, Inc. (US) 2022-05-18 — — EP disclosed
Send feedback