SCHEMBL3269964

SCHEMBL3269964

Cn1ncc(-c2ccc(OCc3ccc4ccccc4n3)cc2)c1-c1cccnc1

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 13/20 0.64
PDE4B Q07343 4/20 0.63
PDE4A P27815 3/20 0.63
PDE3B Q13370 3/20 0.63
PDE3A Q14432 3/20 0.63
LGALS3 P17931 1/20 0.57
PDE4D Q08499 1/20 0.57

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
SCHEMBL30123181 0.89 PDE10A (0.79) PDE10APDE4BPDE4APDE3BPDE3A
SCHEMBL3271199 0.89 PDE10A (0.79) PDE10APDE4BPDE4APDE3BPDE3A
SCHEMBL30123112 0.89 PDE10A (0.79) PDE10APDE4BPDE4APDE3BPDE3A
SCHEMBL3270154 0.89 PDE10A (0.79) PDE10APDE4BPDE4APDE3BPDE3A
SCHEMBL1423719 0.86 PDE10A (0.73) PDE10A
SCHEMBL4162900 0.85 PDE10A (0.73) PDE10APDE4BPDE4APDE3BPDE3A
SCHEMBL3272173 0.83 PDE10A (0.64) PDE10APDE4BPDE4APDE3BPDE3A
SCHEMBL30123176 0.83 PDE10A (0.64) PDE10APDE4BPDE4APDE3BPDE3A
SCHEMBL4870859 0.81 PDE10A (0.86) PDE10APDE4BPDE4APDE3BPDE3A
SCHEMBL188012 0.78 PDE10A (0.63) PDE10APDE4BPDE4APDE3BPDE3A

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-1841757-B1 HETEROAROMATIC QUINOLINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS PFIZER PROD INC (US) 2010-06-30 EP disclosed