SCHEMBL3664644

SCHEMBL3664644

COc1cccc(-c2nc(C)c3c(C)nc4ccc(F)cc4n23)c1.COc1ccccc1-c1nc(C)c2c(C)nc3ccc(F)cc3n12

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.61
PDE2A O00408 18/20 0.61
PDE5A O76074 2/20 0.48
PDE11A Q9HCR9 2/20 0.48
PDE4A P27815 1/20 0.45

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
SCHEMBL970680 0.92 PDE10A (0.58) PDE10APDE2APDE5APDE11A
SCHEMBL969684 0.89 PDE10A (0.75) PDE10APDE2APDE5APDE11A
SCHEMBL968956 0.79 PDE10A (0.64) PDE10APDE2APDE5APDE11A
SCHEMBL970421 0.79 PDE10A (0.71) PDE10APDE2A
SCHEMBL972371 0.79 PDE10A (0.72) PDE10APDE2APDE5APDE11A
SCHEMBL973026 0.77 PDE10A (0.75) PDE10APDE2APDE5APDE11A
SCHEMBL968812 0.77 PDE10A (0.61) PDE10APDE2APDE5APDE11APDE4A
SCHEMBL969614 0.77 PDE10A (1.00) PDE10APDE2APDE5APDE11A
SCHEMBL969540 0.76 PDE10A (0.65) PDE10APDE2APDE11A
SCHEMBL972367 0.76 PDE10A (0.60) PDE10APDE2A

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-2225248-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-A]PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 Wyeth LLC (US) 2010-09-08 EP disclosed
WO-2009070584-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-A]PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 WYETH (US) 2009-06-04 WO disclosed