SCHEMBL31757153

SCHEMBL31757153

COc1cc(C(=O)N2CCOCC2)ccc1Nc1nc(OC)c2cc[nH]c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 20/20 1.00
▸ SLCO1B1 Q9Y6L6 1/20 0.85

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
SCHEMBL18018884 1.00 LRRK2 (1.00) LRRK2SLCO1B1
SCHEMBL16982511 0.92 LRRK2 (1.00) LRRK2SLCO1B1
SCHEMBL16982351 0.90 LRRK2 (0.84) LRRK2SLCO1B1
SCHEMBL18018881 0.89 LRRK2 (1.00) LRRK2SLCO1B1
SCHEMBL21738431 0.89 LRRK2 (0.79) LRRK2SLCO1B1
SCHEMBL16982465 0.87 LRRK2 (0.91) LRRK2SLCO1B1
SCHEMBL18018880 0.87 LRRK2 (1.00) LRRK2SLCO1B1
SCHEMBL18018916 0.87 LRRK2 (1.00) LRRK2SLCO1B1
SCHEMBL16982536 0.87 LRRK2 (1.00) LRRK2SLCO1B1
SCHEMBL18018893 0.86 LRRK2 (1.00) LRRK2SLCO1B1

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-3778604-B1 LRRK2 INHIBITORS AND METHODS OF MAKING AND USING THE SAME DANA FARBER CANCER INST INC (US) 2026-01-07 — — EP disclosed
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