SCHEMBL4931382

SCHEMBL4931382

CCC(NC(=O)c1c(C)nc2c(cnn2CC)c1NC1CCOCC1)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.50
MAPK1 P28482 1/20 0.42
RPS6KA1 Q15418 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE7A Q13946 1/20 0.42
PDE3A Q14432 1/20 0.42

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
SCHEMBL4939148 0.91 PDE4B (0.49) PDE4BMAPK1RPS6KA1
SCHEMBL4927800 0.91 PDE4B (0.50) PDE4BPDE3BPDE7APDE3A
SCHEMBL4937069 0.91 PDE4B (0.49) PDE4BMAPK1RPS6KA1
SCHEMBL4931722 0.89 PDE4B (0.48) PDE4BMAPK1RPS6KA1
SCHEMBL4931730 0.88 PDE4B (0.48) PDE4BMAPK1RPS6KA1
SCHEMBL4933954 0.85 PDE4B (0.67) PDE4B
SCHEMBL13865612 0.83 PDE4B (0.63) PDE4BPDE3BPDE7APDE3A
SCHEMBL13870220 0.82 PDE4B (0.58) PDE4BPDE3BPDE7APDE3A
Hydrochloric Acid SCHEMBL2773651 0.82 PDE4B (0.62) PDE4BPDE3BPDE7APDE3A
SCHEMBL4940347 0.82 PDE4B (0.49) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070111995-A1 Pyrazolo [3,4-B] pyridine Compounds and Their Use as Phosphodiesterase Inhibitors GLAXO GROUP LIMITED (GB) 2007-05-17 US claimed
US-20080132536-A1 PYRAZOLO [3,4-B] PYRIDINE COMPOUNDS, AND THEIR USE AS PDE4 INHIBITORS GLAXO GROUP LIMITED 2008-06-05 US disclosed
US-20070111995-A1 Pyrazolo [3,4-B] pyridine Compounds and Their Use as Phosphodiesterase Inhibitors GLAXO GROUP LIMITED (GB) 2007-05-17 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-20080132536-A1 PYRAZOLO [3,4-B] PYRIDINE COMPOUNDS, AND THEIR USE AS PDE4 INHIBITORS PDE4A, PDE4B, PDE4C PDE4B 2/4885MAPK1 890/4885RPS6KA1 3370/4885
US-20070111995-A1 Pyrazolo [3,4-B] pyridine Compounds and Their Use as Phosphodiesterase Inhibitors PDE4B, PDE3B, PDE4A PDE4B 1/4885MAPK1 1289/4885RPS6KA1 4130/4885

“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.