SCHEMBL3657931

SCHEMBL3657931

CCc1nc(C)c2c(NNc3nc4ccc(F)cc4n4c(-c5ccccc5)nc(C)c34)nc3ccccc3n12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 6/20 0.47
▸ PDE2A O00408 2/20 0.47
▸ TP53 P04637 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ PDE6D O43924 1/20 0.38
▸ PDE8A O60658 1/20 0.38
▸ PDE5A O76074 1/20 0.38
▸ PDE9A O76083 1/20 0.38
▸ PDE8B O95263 1/20 0.38
▸ PDE6A P16499 1/20 0.38
▸ PDE6G P18545 1/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ PDE6B P35913 1/20 0.38

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 0.83 PDE10A (0.55) PDE10APDE2ATP53HTR2CPDE6D
SCHEMBL3658809 0.79 PDE10A (0.54) PDE10APDE2ATP53ALDH1A1HPGD
SCHEMBL970421 0.78 PDE10A (0.71) PDE10APDE2AALDH1A1HPGDKMT2A
SCHEMBL3795533 0.77 PDE10A (0.60) PDE10APDE2APDE5APDE3A
SCHEMBL969869 0.77 PDE10A (0.58) PDE10APDE2APDE6DPDE8APDE5A
SCHEMBL968378 0.74 PDE10A (0.58) PDE10APDE2AALDH1A1HPGDKMT2A
SCHEMBL970002 0.74 PDE10A (0.58) PDE10APDE2AALDH1A1HPGDKMT2A
SCHEMBL3658185 0.73 PDE10A (0.41) PDE10APDE2ATP53MAPTHTR2C
SCHEMBL972333 0.73 RPS6KA5 (0.47) PDE10APDE2APDE6DPDE8APDE5A
SCHEMBL3661029 0.72 PDE10A (0.61) PDE10APDE2ATP53ALDH1A1HPGD

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
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