SCHEMBL5570368

SCHEMBL5570368

FC(F)C(F)n1cc(-c2ccncc2)c(-c2ncc(OCc3ccc4ccccc4n3)cn2)n1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 14/20 0.57
LGALS3 P17931 1/20 0.57
PDE4D Q08499 1/20 0.57
PDE4A P27815 2/20 0.45
PDE4B Q07343 2/20 0.45
PDE3B Q13370 2/20 0.45
PDE3A Q14432 2/20 0.45
CYP1A2 P05177 1/20 0.43

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
SCHEMBL5574198 0.85 PDE10A (0.51) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL4159799 0.85 PDE10A (0.78) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL5574215 0.84 PDE10A (0.56) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL4146861 0.83 PDE10A (0.80) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL4147718 0.77 PDE10A (0.54) PDE10ALGALS3PDE4D
SCHEMBL3269898 0.77 PDE10A (0.78) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL30123678 0.77 PDE10A (0.78) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL4153869 0.74 PDE10A (0.79) PDE10ALGALS3PDE4DPDE4APDE4B
Mardepodect SCHEMBL29496270 0.73 PDE10A (1.00) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL3271928 0.73 PDE10A (1.00) PDE10ALGALS3PDE4DPDE4APDE4B

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-2007129183-A2 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER PRODUCTS INC. (US) 2007-11-15 WO claimed