SCHEMBL7743993

SCHEMBL7743993

COc1ccc(C2CCN(C(C)=O)C2)cc1OC1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 1.00
PDE4A P27815 1/20 0.81
PDE4C Q08493 1/20 0.81
PDE4D Q08499 1/20 0.81

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
SCHEMBL8327025 0.91 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL7342539 0.89 PDE4B (0.81) PDE4BPDE4APDE4CPDE4D
SCHEMBL8328029 0.89 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL7443177 0.87 PDE4B (0.89) PDE4BPDE4APDE4CPDE4D
SCHEMBL7341550 0.86 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL7431229 0.86 PDE4B (0.76) PDE4BPDE4APDE4CPDE4D
SCHEMBL7437810 0.86 PDE4B (0.89) PDE4BPDE4APDE4CPDE4D
SCHEMBL7437791 0.85 PDE4B (0.89) PDE4BPDE4APDE4CPDE4D
SCHEMBL11625752 0.84 PDE4B (0.72) PDE4BPDE4APDE4CPDE4D
SCHEMBL7743949 0.82 PDE4B (0.72) PDE4BPDE4APDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2193808-A1 Synergistic combination Nycomed GmbH (DE) 2010-06-09 EP disclosed
EP-1849468-A2 Pharmaceutical composition of a pde4 or a pde3/4 inhibitor and a histamine receptor antagonist Nycomed GmbH (DE) 2007-10-31 EP disclosed
WO-2004047817-A1 PDE4 AND PDE3/4 INHIBITORS FOR USE IN THE TREATMENT OF CACHEXIA ALTANA PHARMA AG (DE) 2004-06-10 WO disclosed
WO-2003024488-A2 COMBINATION OF A PDE INHIBITOR AND A LEUKOTRIENE RECEPTOR ANTAGONIST ALTANA PHARMA AG (DE) 2003-03-27 WO disclosed
EP-0939633-A4 TREATMENT OF SEPSIS-INDUCED ACUTE RENAL FAILURE AND RENAL VASOCONSTRICTION AND CATECHOLAMINE-INDUCED RENAL AND MESENTERIC VASOCONSTRICTION UNIV PITTSBURGH (US) 2001-09-19 EP disclosed
EP-0939633-A1 TREATMENT OF SEPSIS-INDUCED ACUTE RENAL FAILURE AND RENAL VASOCONSTRICTION AND CATECHOLAMINE-INDUCED RENAL AND MESENTERIC VASOCONSTRICTION UNIVERSITY OF PITTSBURGH (US) 1999-09-08 EP disclosed
US-5849774-A Treatment of sepsis-induced acute renal failure UNIVERSITY OF PITTSBURGH (US) 1998-12-15 US disclosed
WO-1998000135-A1 TREATMENT OF SEPSIS-INDUCED ACUTE RENAL FAILURE AND RENAL VASOCONSTRICTION AND CATECHOLAMINE-INDUCED RENAL AND MESENTERIC VASOCONSTRICTION UNIVERSITY OF PITTSBURGH (US) 1998-01-08 WO disclosed