SCHEMBL14729582

SCHEMBL14729582

Cc1ccc(-n2cc(OCc3ccccc3)c(=O)c(-c3ccnn3-c3ccccc3)n2)c(F)c1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.62

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
SCHEMBL14723073 0.90 PDE10A (0.60) PDE10A
SCHEMBL16627456 0.88 PDE10A (0.80) PDE10A
SCHEMBL519110 0.86 PDE10A (0.71) PDE10A
SCHEMBL14722570 0.85 PDE10A (0.64) PDE10A
SCHEMBL16625717 0.84 PDE10A (0.61) PDE10A
SCHEMBL14723008 0.84 PDE10A (0.80) PDE10A
SCHEMBL14723261 0.82 PDE10A (0.65) PDE10A
SCHEMBL18399520 0.81 PDE10A (0.80) PDE10A
SCHEMBL15195493 0.80 PDE10A (0.76) PDE10A
SCHEMBL518905 0.80 PDE10A (0.79) 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
WO-2013027845-A1 RADIOLABELED COMPOUNDS AND THEIR USE AS RADIOTRACERS FOR QUANTITATIVE IMAGING OF PHOSPHODIESTERASE (PDE10A) IN MAMMALS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 WO disclosed