SCHEMBL2596231

SCHEMBL2596231

Cn1c(C(=O)N2CC(c3nccnc3N3CCCCC3)C2)nc2ccccc21.N#Cc1cccc(-c2nccnc2C2CN(C(=O)c3nc4ccccc4[nH]3)C2)c1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.72

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
SCHEMBL7698901 0.85 PDE10A (1.00) PDE10A
SCHEMBL2596202 0.79 PDE10A (1.00) PDE10A
SCHEMBL2595844 0.78 PDE10A (1.00) PDE10A
SCHEMBL2590721 0.78 PDE10A (1.00) PDE10A
SCHEMBL2595848 0.78 PDE10A (1.00) PDE10A
SCHEMBL2596126 0.76 PDE10A (1.00) PDE10A
SCHEMBL2595820 0.75 PDE10A (1.00) PDE10A
SCHEMBL2596163 0.74 PDE10A (1.00) PDE10A
SCHEMBL7697049 0.74 PDE10A (1.00) PDE10A
SCHEMBL2595974 0.73 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2569300-A1 NITROGEN HETEROCYCLIC COMPOUNDS USEFUL AS PDE10 INHIBITORS Amgen Inc. (US) 2013-03-20 EP claimed
WO-2011143365-A1 NITROGEN HETEROCYCLIC COMPOUNDS USEFUL AS PDE10 INHIBITORS AMGEN INC. (US) 2011-11-17 WO claimed