SCHEMBL7906405

SCHEMBL7906405

Cc1cc(-n2nccc2-c2nn(-c3cccc(N)c3)ccc2=O)ccn1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.54
HTT P42858 1/20 0.39
NR3C2 P08235 1/20 0.38
ALDH1A1 P00352 3/20 0.38
ELOVL1 Q9BW60 1/20 0.37
PKM P14618 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL2750773 0.88 PDE10A (0.57) PDE10AHTTNR3C2ALDH1A1ELOVL1
SCHEMBL2498709 0.88 PDE10A (0.55) PDE10AHTTNR3C2ALDH1A1ELOVL1
SCHEMBL3505270 0.88 PDE10A (0.55) PDE10AHTTNR3C2ALDH1A1ELOVL1
SCHEMBL14315130 0.86 PDE10A (0.62) PDE10AHTTALDH1A1PKM
SCHEMBL2503833 0.85 PDE10A (0.52) PDE10AHTTALDH1A1ELOVL1
SCHEMBL2476580 0.85 PDE10A (0.52) PDE10AHTTNR3C2ALDH1A1ELOVL1
SCHEMBL7908353 0.85 PDE10A (0.68) PDE10AHTTNR3C2ALDH1A1PKM
SCHEMBL3507069 0.85 PDE10A (0.61) PDE10AHTTNR3C2ALDH1A1ELOVL1
SCHEMBL7911489 0.84 PDE10A (0.58) PDE10AHTTNR3C2ALDH1A1
SCHEMBL2476174 0.84 PDE10A (0.50) PDE10AHTTNR3C2ALDH1A1ELOVL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373641-B1 PYRIDAZINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2012-12-19 EP disclosed
WO-2010063610-A1 PYRIDAZINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-06-10 WO disclosed