SCHEMBL3660862

SCHEMBL3660862

CCCc1nc(C)c2c(C)nc3ccccc3n12.CCCc1nc(C)c2c(N)nc3cc(OC)ccc3n12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 8/20 0.46
PDE2A O00408 5/20 0.46
PDE5A O76074 1/20 0.46
PDE4A P27815 1/20 0.46
PDE4D Q08499 1/20 0.46
PDE7A Q13946 1/20 0.46
PDE3A Q14432 1/20 0.46
PDE11A Q9HCR9 1/20 0.46
PDE7B Q9NP56 1/20 0.46
CNR2 P34972 1/20 0.43
RPS6KA5 O75582 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
TLR7 Q9NYK1 3/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 2/20 0.40

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
SCHEMBL970788 0.93 RPS6KA5 (0.47) PDE10APDE2APDE5APDE4APDE4D
SCHEMBL973647 0.88 PDE10A (0.56) PDE10APDE2APDE5APDE4APDE4D
SCHEMBL970200 0.86 PDE10A (0.49) PDE10APDE2APDE5APDE4APDE4D
SCHEMBL971457 0.86 TLR7 (0.52) PDE10APDE2APDE5APDE4APDE4D
SCHEMBL969451 0.81 PDE10A (0.60) PDE10APDE2APDE5APDE4APDE4D
SCHEMBL971822 0.81 PDE10A (0.63) PDE10APDE2APDE5APDE4APDE4D
SCHEMBL970412 0.76 PDE10A (0.52) PDE10APDE2APDE5APDE4APDE4D
SCHEMBL3660549 0.76 PDE10A (0.64) PDE10APDE2APDE5APDE4APDE4D
SCHEMBL3667892 0.75 PDE2A (0.47) PDE10APDE2APDE4APDE4DPDE7A
SCHEMBL970509 0.75 PDE10A (0.58) 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