SCHEMBL5154746

SCHEMBL5154746

CCC(NC(=O)c1cnc2c(cnn2CC)c1NC1CCOCC1)c1ccc(C)cc1C.CCC(NC(=O)c1cnc2c(cnn2CC)c1NC1CCOCC1)c1cccc(C)c1C

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 19/20 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
SCHEMBL4934777 0.94 PDE4B (0.64) PDE4B
SCHEMBL4934822 0.94 PDE4B (0.64) PDE4B
SCHEMBL4937907 0.94 PDE4B (0.64) PDE4B
SCHEMBL4931313 0.94 PDE4B (0.64) PDE4B
Hydrochloric Acid SCHEMBL4932521 0.94 PDE4B (0.63) PDE4B
SCHEMBL4935669 0.90 PDE4B (0.66) PDE4B
SCHEMBL4934826 0.88 PDE4B (0.64) PDE4B
SCHEMBL4927710 0.87 PDE4B (0.59) PDE4B
SCHEMBL4935807 0.87 PDE4B (0.59) PDE4B
SCHEMBL4932499 0.86 PDE4B (0.65) PDE4B

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-1737857-A1 PYRAZOLO[3,4-B] PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2007-01-03 EP disclosed
WO-2005058892-A1 PYRAZOLO [3,4-B] PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-06-30 WO disclosed