SCHEMBL4337611

SCHEMBL4337611

CCn1ncc2c(NC3CCC3)c(C(=O)NCc3ccc(OC)cc3)cnc21

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 11/20 0.69
PDE4D Q08499 6/20 0.56
PDE5A O76074 2/20 0.55
NR3C1 P04150 1/20 0.55

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
SCHEMBL4337128 0.97 PDE4B (0.68) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4475060 0.97 PDE4B (0.68) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4337717 0.94 PDE4B (0.61) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4337722 0.94 PDE4B (0.61) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4952475 0.94 PDE4B (0.61) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4339731 0.93 PDE4B (0.67) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4335215 0.92 PDE4B (0.66) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4339877 0.92 PDE4B (0.66) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4339870 0.92 PDE4B (0.66) PDE4BPDE4DPDE5ANR3C1
SCHEMBL4343317 0.92 PDE4B (0.81) PDE4BPDE5ANR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060089375-A1 Pyrazolo[3,4-b] pyridine compounds, and their use as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2006-04-27 US 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
US-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors GLAXO GROUP LIMITED 2008-07-24 US disclosed
US-20060089375-A1 Pyrazolo[3,4-b] pyridine compounds, and their use as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2006-04-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors PDE5A, PDE3B, PDE4A PDE4B 4/4885PDE4D 22/4885PDE5A 1/4885
US-20060089375-A1 Pyrazolo[3,4-b] pyridine compounds, and their use as phosphodiesterase inhibitors PDE5A, PDE3B, PDE4A PDE4B 4/4885PDE4D 22/4885PDE5A 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.