SCHEMBL3658185

SCHEMBL3658185

CCc1nc(C)c2c(NS(=O)(=O)CN(c3nc4ccccc4n4c(CC)nc(C)c34)S(C)(=O)=O)nc3ccc(F)cc3n12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 9/20 0.41
▸ TP53 P04637 1/20 0.36
▸ PDE2A O00408 3/20 0.36
▸ PDE5A O76074 2/20 0.35
▸ PDE3A Q14432 2/20 0.35
▸ PDE6D O43924 1/20 0.35
▸ PDE8A O60658 1/20 0.35
▸ PDE9A O76083 1/20 0.35
▸ PDE8B O95263 1/20 0.35
▸ PDE6A P16499 1/20 0.35
▸ PDE6G P18545 1/20 0.35
▸ PDE4A P27815 1/20 0.35
▸ PDE6B P35913 1/20 0.35
▸ PDE6C P51160 1/20 0.35
▸ PDE1A P54750 1/20 0.35
▸ PDE1B Q01064 1/20 0.35
▸ PDE4B Q07343 1/20 0.35
▸ PDE4C Q08493 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ PDE3B Q13370 1/20 0.35

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
SCHEMBL3658183 0.85 PDE10A (0.55) PDE10ATP53PDE2APDE5APDE3A
SCHEMBL3795533 0.80 PDE10A (0.60) PDE10APDE2APDE5APDE3APDE11A
SCHEMBL3657693 0.80 PDE2A (0.42) PDE10APDE2A
SCHEMBL3661029 0.76 PDE10A (0.61) PDE10ATP53PDE2APDE5APDE3A
SCHEMBL3657931 0.73 PDE10A (0.47) PDE10ATP53PDE2APDE5APDE3A
SCHEMBL3662037 0.73 PDE10A (0.61) PDE10APDE2APDE5APDE3APDE11A
SCHEMBL969869 0.70 PDE10A (0.58) PDE10APDE2APDE5APDE3APDE6D
SCHEMBL3658809 0.68 PDE10A (0.54) PDE10ATP53PDE2APDE5APDE3A
SCHEMBL972333 0.67 RPS6KA5 (0.47) PDE10APDE2APDE5APDE3APDE6D
SCHEMBL972979 0.66 PDE10A (0.57) PDE10APDE2APDE5APDE3APDE6D

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-2227472-A1 ARYL AND HETEROARYL FUSED IMIDAZO (1,5-A) PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 Elbion Gmbh (DE) 2010-09-15 — — EP disclosed
WO-2009068320-A1 ARYL AND HETEROARYL FUSED IMIDAZO (1,5-A) PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 ELBION GMBH (DE) 2009-06-04 — — WO disclosed
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