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SCHEMBL3665677

SCHEMBL3665677

COc1cc(F)c2nc(C)c3c(C)nc(-c4ccc(F)c(C(N)=O)c4)n3c2c1.COc1cc(F)c2nc(C)c3c(C)nc(-c4ccccc4Cl)n3c2c1.COc1cc(F)c2nc(C)c3c(C)nc(-c4cccnc4C)n3c2c1.COc1cc(F)c2nc(C)c3c(C)nc(-c4ccncc4C)n3c2c1.COc1cc(F)c2nc(C)c3c(C)nc(-c4cnccc4C)n3c2c1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 20/20 0.57
▸ PDE2A O00408 18/20 0.57
▸ PDE11A Q9HCR9 4/20 0.46
▸ PDE5A O76074 3/20 0.46
▸ PDE4A P27815 1/20 0.45
▸ ADORA2A P29274 1/20 0.42
▸ ADORA1 P30542 1/20 0.42

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
SCHEMBL969759 0.79 PDE10A (0.56) PDE10APDE2APDE11APDE5APDE4A
SCHEMBL3661816 0.76 PDE10A (0.48) PDE10APDE2APDE11APDE5A
SCHEMBL970252 0.76 PDE10A (1.00) PDE10APDE2APDE11APDE5AADORA2A
SCHEMBL970990 0.76 PDE10A (1.00) PDE10APDE2APDE11APDE5APDE4A
SCHEMBL970617 0.75 PDE10A (0.74) PDE10APDE2APDE11APDE5APDE4A
SCHEMBL972085 0.74 PDE10A (1.00) PDE10APDE2APDE11APDE5APDE4A
SCHEMBL2790561 0.72 PDE10A (0.84) PDE10APDE2APDE11APDE5APDE4A
SCHEMBL2846138 0.72 PDE10A (1.00) PDE10APDE2APDE11APDE5APDE4A
SCHEMBL2788635 0.71 PDE10A (0.78) PDE10APDE2APDE11APDE5APDE4A
SCHEMBL969322 0.71 PDE10A (0.77) PDE10APDE2APDE11APDE5APDE4A

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