SCHEMBL7707934

SCHEMBL7707934

CCCCCCN1CC(c2ccc(C3CO3)c3oc4cnccc4c23)CC1=O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.40
TP53 P04637 2/20 0.33
POLB P06746 3/20 0.33
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL2563205 0.87 PDE10A (0.53) PDE10ATP53POLB
SCHEMBL2559772 0.87 PDE10A (0.53) PDE10ATP53POLB
SCHEMBL2557912 0.86 PDE10A (0.46) PDE10ATP53POLBMAPTNPSR1
SCHEMBL2556902 0.86 PDE10A (0.54) PDE10ATP53POLB
SCHEMBL2557293 0.83 PDE10A (0.43) PDE10ATP53POLBMAPTNPSR1
SCHEMBL2576250 0.77 PDE10A (0.46) PDE10ATP53POLB
SCHEMBL2575117 0.76 PDE10A (0.52) PDE10A
SCHEMBL2575124 0.75 PDE10A (0.55) PDE10A
SCHEMBL2559622 0.74 PDE10A (0.54) PDE10A
SCHEMBL2560140 0.73 PDE10A (0.47) PDE10ATP53POLB

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 disclosed