SCHEMBL8312183

SCHEMBL8312183

CCn1ncc2c(NC3CCOCC3)c(C(=O)NNC)c(C)nc21

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.59
PDE3B Q13370 1/20 0.51
PDE7A Q13946 1/20 0.51
PDE3A Q14432 1/20 0.51

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
SCHEMBL13865612 0.92 PDE4B (0.63) PDE4BPDE3BPDE7APDE3A
SCHEMBL13870220 0.91 PDE4B (0.58) PDE4BPDE3BPDE7APDE3A
Hydrochloric Acid SCHEMBL2773651 0.91 PDE4B (0.62) PDE4BPDE3BPDE7APDE3A
SCHEMBL2774432 0.90 PDE4B (0.56) PDE4BPDE3BPDE7APDE3A
SCHEMBL221173 0.89 PDE4B (0.61) PDE4BPDE3BPDE7APDE3A
SCHEMBL2775159 0.89 PDE4B (0.55) PDE4BPDE3BPDE7APDE3A
SCHEMBL13870254 0.88 PDE4B (0.54) PDE4BPDE3BPDE7APDE3A
SCHEMBL222815 0.87 PDE4B (0.72) PDE4B
SCHEMBL2773212 0.86 PDE4B (0.54) PDE4BPDE3BPDE7APDE3A
SCHEMBL4330493 0.85 PDE4B (0.73) PDE4BPDE3BPDE7APDE3A

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-2004056823-A1 PYRAZOLO[3,4-b]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-07-08 WO disclosed