SCHEMBL24313964

SCHEMBL24313964

CC[S+]([O-])c1cc(C(C)(C)C#N)cnc1-c1nc2cc(C(F)(F)F)nnc2n1C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 1/20 0.30

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
SCHEMBL31476290 0.88 POLB (0.40) LRRK2
SCHEMBL30951759 0.88 POLB (0.40) LRRK2
SCHEMBL30951760 0.88 POLB (0.40) LRRK2
SCHEMBL31476245 0.87 LRRK2 (0.30) LRRK2
SCHEMBL31476227 0.87 LRRK2 (0.30) LRRK2
SCHEMBL24314119 0.87 LRRK2 (0.30) LRRK2
SCHEMBL31476242 0.86 — —
SCHEMBL31476285 0.86 — —
SCHEMBL20406049 0.84 — —
SCHEMBL20276043 0.82 — —

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-3585770-B1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2022-03-23 — — EP disclosed
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