SCHEMBL2887789

SCHEMBL2887789

COc1ccc(C2=NN(C3CCN(C(=O)NC(C)(C)C)CC3)C(=O)[C@@H]3CC=CC[C@H]23)cc1OC

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 18/20 0.68
PDE4B Q07343 12/20 0.68
PDE4A P27815 11/20 0.68
PDE4C Q08493 11/20 0.68
PDE7B Q9NP56 1/20 0.61

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
SCHEMBL6286337 1.00 PDE4D (0.68) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL5875876 0.89 PDE4D (0.57) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL2888335 0.89 PDE4D (0.57) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6489896 0.87 PDE4D (0.61) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6479899 0.86 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6479903 0.84 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6485190 0.84 PDE4D (0.71) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL5553386 0.84 PDE4D (0.78) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6485199 0.84 PDE4D (0.71) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6256486 0.83 PDE7B (0.85) PDE4DPDE4BPDE4APDE4CPDE7B

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006528229-A 2006-12-14 JP claimed
US-20060094723-A1 Composition comprising a pde4 inhibitor and a pde5 inhibitor NYCOMED GMBH (DE) 2006-05-04 US claimed
EP-1628682-A2 COMPOSITION COMPRISING A PDE4 INHIBITOR AND A PDE5 INHIBITOR ALTANA Pharma AG (DE) 2006-03-01 EP claimed
EP-1587512-A2 PDE4 INHIBITORS FOR THE TREATMENT OF NEOPLASMS OF LYMPHOID CELLS ALTANA Pharma AG (DE) 2005-10-26 EP claimed
US-6953853-B2 Phospholipase inhbitors; antiinflammatory agents; respiratory system disorders ALTANA PHARMA AG (DE) 2005-10-11 US claimed
WO-2005023253-A1 USE OF PDE4 INHIBITORS FOR THE TREATMENT OF DIABETES MELLITUS ALTANA PHARMA AG (DE) 2005-03-17 WO claimed
WO-2004103407-A2 COMPOSITION COMPRISING A PDE4 INHIBITOR AND A PDE5 INHIBITOR ALTANA PHARMA AG (DE) 2004-12-02 WO claimed
WO-2004098633-A1 COMPOSITION COMPRISING A PDE-4 INHIBITOR AND A TNF ALPHA ANTAGONIST ALTANA PHARMA AG (DE) 2004-11-18 WO claimed
WO-2004098605-A1 PHARMACEUTICAL COMPOSITION COMPRISING A PDE4 INHIBITOR AND IL-1 TRAP ALTANA PHARMA AG (DE) 2004-11-18 WO claimed
WO-2004098606-A1 COMPOSITION COMPRISING A PDE4 INHIBITOR AND SHUIL-1R II ALTANA PHARMA AG (DE) 2004-11-18 WO claimed
WO-2004098578-A2 COMPOSITION COMPRISING A PDE4 INHIBITOR AND A TNF-ALFA ANTAGONIST SELECTED FROM INFLIXIMAB, ADALIMUMAB, CDP870 AND CDP517 ALTANA PHARMA AG (DE) 2004-11-18 WO claimed
WO-2004062671-A2 PDE4 INHIBITORS FOR THE TREATMENT OF NEOPLASMS OF LYMPHOID CELLS ALTANA PHARMA AG (DE) 2004-07-29 WO claimed
US-20040067946-A1 Phthalatyinone-piperidino-derivatives as pde4 inhibitors TAKEDA GMBH (DE) 2004-04-08 US claimed
EP-1362044-A1 PHTHALAZINONE-PIPERIDINO-DERIVATIVES AS PDE4 INHIBITORS ALTANA Pharma AG (DE) 2003-11-19 EP claimed
WO-2002064584-A1 PHTHALAYINONE-PIPERIDINO-DERIVATIVES AS PDE4 INHIBITORS ALTANA PHARMA AG (DE) 2002-08-22 WO claimed
US-7776893-B2 Use of PDE4 inhibitors for the treatment of diabetes mellitus NYCOMED GMBH (DE) 2010-08-17 US disclosed
US-7531540-B2 Phthalazinone-piperidino-derivatives as PDE4 inhibitors NYCOMED GMBH (DE) 2009-05-12 US disclosed
US-20040067946-A1 Phthalatyinone-piperidino-derivatives as pde4 inhibitors TAKEDA GMBH (DE) 2004-04-08 US disclosed
EP-1362044-A1 PHTHALAZINONE-PIPERIDINO-DERIVATIVES AS PDE4 INHIBITORS ALTANA Pharma AG (DE) 2003-11-19 EP disclosed
WO-2002064584-A1 PHTHALAYINONE-PIPERIDINO-DERIVATIVES AS PDE4 INHIBITORS ALTANA PHARMA AG (DE) 2002-08-22 WO 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-20060094723-A1 Composition comprising a pde4 inhibitor and a pde5 inhibitor PDE5A, PDE12, PDE4A PDE4D 9/4885PDE4B 4/4885PDE4A 3/4885
US-20040067946-A1 Phthalatyinone-piperidino-derivatives as pde4 inhibitors PDE4A, PDE4B, PDE5A PDE4D 9/4885PDE4B 2/4885PDE4A 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.