SCHEMBL5875839

SCHEMBL5875839

CCOc1ccc(C2=NN(C3CCN(C(=O)CN4CCN(CCN(C)C)CC4)CC3)C(=O)C3CC=CCC23)cc1OCC

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 19/20 0.60
PDE4A P27815 11/20 0.56
PDE4B Q07343 11/20 0.56
PDE4C Q08493 11/20 0.56
PDE7B Q9NP56 1/20 0.49

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
SCHEMBL2889850 1.00 PDE4D (0.60) PDE4DPDE4APDE4BPDE4CPDE7B
Hydrochloric Acid SCHEMBL4357313 0.99 PDE4D (0.59) PDE4DPDE4APDE4BPDE4CPDE7B
Hydrochloric Acid SCHEMBL5559987 0.90 PDE4D (0.58) PDE4DPDE4APDE4BPDE4CPDE7B
SCHEMBL2886875 0.88 PDE4D (0.63) PDE4DPDE4APDE4BPDE4CPDE7B
SCHEMBL5875874 0.88 PDE4D (0.63) PDE4DPDE4APDE4BPDE4CPDE7B
Hydrochloric Acid SCHEMBL4011677 0.88 PDE4D (0.62) PDE4DPDE4APDE4BPDE4CPDE7B
SCHEMBL5958810 0.87 PDE4D (0.52) PDE4DPDE4APDE4BPDE4C
SCHEMBL4011641 0.85 PDE4D (0.63) PDE4DPDE4APDE4BPDE4CPDE7B
SCHEMBL2881703 0.84 PDE4D (0.61) PDE4DPDE4APDE4BPDE4CPDE7B
SCHEMBL6435630 0.84 PDE4D (0.61) PDE4DPDE4APDE4BPDE4CPDE7B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006528229-A 2006-12-14 JP 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
EP-1482938-A1 PHARMACEUTICAL COMPOSITION OF A PDE4 OR A PDE3/4 INHIBITOR AND A HISTAMINE RECEPTOR ANTAGONIST ALTANA Pharma AG (DE) 2004-12-08 EP 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-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
WO-2003074055-A1 PHARMACEUTICAL COMPOSITION OF A PDE4 OR A PDE3/4 INHIBITOR AND A HISTAMINE RECEPTOR ANTAGONIST ALTANA PHARMA AG (DE) 2003-09-12 WO claimed
EP-2804603-A1 BETA-CELL REPLICATION PROMOTING COMPOUNDS AND METHODS OF THEIR USE President and Fellows of Harvard College (US) 2014-11-26 EP disclosed
WO-2013106547-A1 BETA-CELL REPLICATION PROMOTING COMPOUNDS AND METHODS OF THEIR USE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-07-18 WO disclosed
EP-1628682-A2 COMPOSITION COMPRISING A PDE4 INHIBITOR AND A PDE5 INHIBITOR ALTANA Pharma AG (DE) 2006-03-01 EP disclosed
EP-1587512-A2 PDE4 INHIBITORS FOR THE TREATMENT OF NEOPLASMS OF LYMPHOID CELLS ALTANA Pharma AG (DE) 2005-10-26 EP disclosed
EP-1482938-A1 PHARMACEUTICAL COMPOSITION OF A PDE4 OR A PDE3/4 INHIBITOR AND A HISTAMINE RECEPTOR ANTAGONIST ALTANA Pharma AG (DE) 2004-12-08 EP disclosed
WO-2004103407-A2 COMPOSITION COMPRISING A PDE4 INHIBITOR AND A PDE5 INHIBITOR ALTANA PHARMA AG (DE) 2004-12-02 WO disclosed
WO-2004098633-A1 COMPOSITION COMPRISING A PDE-4 INHIBITOR AND A TNF ALPHA ANTAGONIST ALTANA PHARMA AG (DE) 2004-11-18 WO disclosed
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 disclosed
WO-2004062671-A2 PDE4 INHIBITORS FOR THE TREATMENT OF NEOPLASMS OF LYMPHOID CELLS ALTANA PHARMA AG (DE) 2004-07-29 WO disclosed
WO-2003074055-A1 PHARMACEUTICAL COMPOSITION OF A PDE4 OR A PDE3/4 INHIBITOR AND A HISTAMINE RECEPTOR ANTAGONIST ALTANA PHARMA AG (DE) 2003-09-12 WO disclosed