SCHEMBL19789934

SCHEMBL19789934

COc1cn(-c2ccc(-n3cccn3)cc2F)nc(-c2ccnn2-c2cc(C)ccc2F)c1=O

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.60

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
SCHEMBL10039510 0.92 PDE10A (0.60) PDE10A
SCHEMBL518932 0.91 PDE10A (0.70) PDE10A
SCHEMBL30123211 0.91 PDE10A (0.70) PDE10A
SCHEMBL15004673 0.89 PDE10A (0.70) PDE10A
Balipodect SCHEMBL518714 0.88 PDE10A (0.77) PDE10A
Balipodect SCHEMBL30123098 0.88 PDE10A (0.77) PDE10A
SCHEMBL30123282 0.87 PDE10A (0.65) PDE10A
SCHEMBL519199 0.87 PDE10A (0.65) PDE10A
SCHEMBL15004727 0.85 PDE10A (0.59) PDE10A
SCHEMBL18973429 0.85 PDE10A (0.59) PDE10A

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
EP-2748158-B1 RADIOLABELED COMPOUNDS AND THEIR USE AS RADIOTRACERS FOR QUANTITATIVE IMAGING OF PHOSPHODIESTERASE (PDE10A) IN MAMMALS TAKEDA PHARMACEUTICALS CO (JP) 2018-01-24 EP disclosed