SCHEMBL2596322

SCHEMBL2596322

CC(C)(C)N(C(=O)O)[C@H]1CCCN(c2nccnc2C2CN(c3ccc4ccccc4n3)C2)C1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.66

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
SCHEMBL2596329 1.00 PDE10A (0.66) PDE10A
SCHEMBL2595755 0.95 PDE10A (0.73) PDE10A
SCHEMBL2596325 0.91 PDE10A (0.67) PDE10A
SCHEMBL2593588 0.84 PDE10A (0.82) PDE10A
SCHEMBL9988545 0.82 PDE10A (0.72) PDE10A
SCHEMBL17209607 0.81 PDE10A (0.49) PDE10A
SCHEMBL27934389 0.81 PDE10A (0.69) PDE10A
SCHEMBL9988421 0.80 PDE10A (0.77) PDE10A
SCHEMBL16454489 0.80 PDE10A (1.00) PDE10A
SCHEMBL16454446 0.80 PDE10A (1.00) 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
WO-2011143365-A1 NITROGEN HETEROCYCLIC COMPOUNDS USEFUL AS PDE10 INHIBITORS AMGEN INC. (US) 2011-11-17 WO claimed