SCHEMBL6915932

SCHEMBL6915932

C=C(C)c1cccc(-c2cn3ccc(NC(=O)c4c(C(=O)N5CCC5)cnn4C)nc3n2)c1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.57

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
SCHEMBL2372991 0.90 PDE10A (0.59) PDE10A
SCHEMBL2388072 0.90 PDE10A (0.64) PDE10A
SCHEMBL2373185 0.89 PDE10A (0.59) PDE10A
SCHEMBL2373577 0.89 PDE10A (0.59) PDE10A
SCHEMBL2395216 0.89 PDE10A (0.59) PDE10A
SCHEMBL2386273 0.89 PDE10A (0.71) PDE10A
SCHEMBL2374141 0.88 PDE10A (0.64) PDE10A
SCHEMBL2373782 0.88 PDE10A (0.56) PDE10A
SCHEMBL2385835 0.87 PDE10A (0.71) PDE10A
SCHEMBL2373581 0.86 PDE10A (0.70) 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-2011117264-A1 N-(IMIDAZOPYRIMIDIN-7-YL)-HETEROARYLAMIDE DERIVATIVES AND THEIR USE AS PDE10A INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-09-29 WO disclosed