SCHEMBL18660523

SCHEMBL18660523

Cn1ncc(C(=O)N2CCOCC2)c1OC(=O)Nc1ccc2nc(N3CCOCC3)nn2c1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.74

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
SCHEMBL18660533 0.97 PDE10A (0.70) PDE10A
SCHEMBL18660512 0.92 PDE10A (0.76) PDE10A
SCHEMBL18660511 0.91 PDE10A (0.73) PDE10A
SCHEMBL18660505 0.90 PDE10A (0.73) PDE10A
SCHEMBL18660510 0.87 PDE10A (0.59) PDE10A
SCHEMBL14822159 0.85 PDE10A (1.00) PDE10A
SCHEMBL14822224 0.82 PDE10A (0.93) PDE10A
SCHEMBL14822211 0.82 PDE10A (1.00) PDE10A
SCHEMBL14821987 0.82 PDE10A (1.00) PDE10A
SCHEMBL18660525 0.79 PDE10A (0.74) PDE10A

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-2758396-B1 TRIAZOLOPYRIDINE COMPOUNDS AS PDE10A INHIBITORS HOFFMANN LA ROCHE (CH) 2017-03-29 EP claimed