SCHEMBL9926295

SCHEMBL9926295

Cn1ncc(C(=O)N2CC3(COC3)C2)c1C(=O)Nc1ccn2nc(I)nc2c1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.53

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
SCHEMBL9108884 0.91 PDE10A (0.65) PDE10A
SCHEMBL10267145 0.90 PDE10A (0.63) PDE10A
SCHEMBL9926282 0.87 PDE10A (0.61) PDE10A
SCHEMBL9107086 0.81 PDE10A (0.78) PDE10A
SCHEMBL9926272 0.81 PDE10A (0.47) PDE10A
SCHEMBL9107144 0.80 PDE10A (0.78) PDE10A
SCHEMBL9107438 0.80 PDE10A (0.63) PDE10A
SCHEMBL9105589 0.80 PDE10A (0.73) PDE10A
SCHEMBL9104717 0.80 PDE10A (0.79) PDE10A
SCHEMBL9109646 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-2012076430-A1 TRIAZOLOPYRIDINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2012-06-14 WO disclosed