SCHEMBL2576211

SCHEMBL2576211

O=C1CC(c2ccc(OC(F)F)c3oc4ccncc4c23)CN1Cc1cccc2cccnc12

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.51
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
CYP19A1 P11511 3/20 0.32
CYP11B1 P15538 3/20 0.32
CYP11B2 P19099 3/20 0.32
CYP17A1 P05093 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.31
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30

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
SCHEMBL2563116 0.88 PDE10A (0.59) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2563558 0.87 PDE10A (0.55) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2563663 0.87 PDE10A (0.53) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2557009 0.87 PDE10A (0.55) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2563691 0.86 PDE10A (0.55) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2553791 0.86 PDE10A (0.52) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2563284 0.85 PDE10A (0.56) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2557842 0.85 PDE10A (0.51) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2561222 0.85 PDE10A (0.51) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL2586394 0.85 PDE10A (0.56) PDE10APDE4APDE4BPDE4CPDE4D

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011132051-A2 TRICYCLE COMPOUNDS AS PHOSPHODIESTERASE-10 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2011-10-27 WO claimed