SCHEMBL4558649

SCHEMBL4558649

CCOC(=O)c1cnc2c(cnn2CC)c1NC1CCOC1

nearest known ligand 0.89

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.89
PDE5A O76074 1/20 0.59

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
SCHEMBL4336029 1.00 PDE4B (0.89) PDE4BPDE5A
SCHEMBL4349536 1.00 PDE4B (0.89) PDE4BPDE5A
SCHEMBL4338000 0.94 PDE4B (0.80) PDE4BPDE5A
SCHEMBL583180 0.94 PDE4B (1.00) PDE4B
SCHEMBL582697 0.89 PDE4B (0.92) PDE4BPDE5A
SCHEMBL4334216 0.88 PDE4B (0.73) PDE4B
SCHEMBL5963176 0.87 PDE4B (0.88) PDE4B
SCHEMBL583169 0.87 PDE4B (1.00) PDE4BPDE5A
SCHEMBL2774197 0.86 PDE4B (1.00) PDE4B
SCHEMBL583691 0.86 PDE4B (1.00) PDE4BPDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539753-A2 PYRAZOLO(3,4-B)PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-06-15 EP claimed
WO-2004024728-A2 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-03-25 WO claimed
EP-1539753-B1 PYRAZOLO(3,4-B)PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2009-09-09 EP disclosed