SCHEMBL582406

SCHEMBL582406

CCn1ncc2c(NC3CCCCC3)c(C3=NOC4(CCN(C(=O)O)CC4)C3)cnc21

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.51
PDE7A Q13946 1/20 0.49
PDE4D Q08499 5/20 0.41

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
SCHEMBL582356 0.94 PDE4B (0.51) PDE4BPDE7APDE4D
SCHEMBL583584 0.94 PDE4B (0.49) PDE4BPDE7APDE4D
SCHEMBL583030 0.93 PDE4B (0.49) PDE4BPDE7A
Bicarbonate SCHEMBL583387 0.92 PDE4B (0.54) PDE4BPDE7APDE4D
Bicarbonate SCHEMBL583185 0.92 PDE4B (0.54) PDE4BPDE7APDE4D
Bicarbonate SCHEMBL583625 0.92 PDE4B (0.54) PDE4BPDE7APDE4D
SCHEMBL581944 0.91 PDE4B (0.51) PDE4BPDE7APDE4D
Bicarbonate SCHEMBL582309 0.90 PDE4B (0.51) PDE4BPDE7APDE4D
SCHEMBL582302 0.90 PDE4B (0.49) PDE4BPDE7APDE4D
SCHEMBL582555 0.89 PDE4B (0.51) PDE4BPDE7APDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420666-B2 Pyrazolo (3, 4-B) pyridine derivatives as phosphodiesterase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2013-04-16 US claimed
EP-2124944-B1 Pyrazolo[3,4-b]pyridine derivatives as phosphodiesterase inhibitors RANBAXY LAB LTD (IN) 2012-02-15 EP claimed
US-20100292196-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2010-11-18 US claimed
US-8420666-B2 Pyrazolo (3, 4-B) pyridine derivatives as phosphodiesterase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2013-04-16 US disclosed
EP-2124944-B1 Pyrazolo[3,4-b]pyridine derivatives as phosphodiesterase inhibitors RANBAXY LAB LTD (IN) 2012-02-15 EP disclosed
US-20100292196-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2010-11-18 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 (1 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-20100292196-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS PDE3B, PDE4A, PDE3A PDE4B 5/4885PDE7A 4/4885PDE4D 11/4885

“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.