SCHEMBL7743949

SCHEMBL7743949

COc1ccc(C2CCN(NC(N)=O)C2)cc1OC1CCCC1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.72
PDE4A P27815 1/20 0.71
PDE4C Q08493 1/20 0.71
PDE4D Q08499 1/20 0.71

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 0.84 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL8328029 0.83 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL7743993 0.82 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL7342539 0.81 PDE4B (0.81) PDE4BPDE4APDE4CPDE4D
SCHEMBL7443177 0.81 PDE4B (0.89) PDE4BPDE4APDE4CPDE4D
SCHEMBL7437810 0.80 PDE4B (0.89) PDE4BPDE4APDE4CPDE4D
SCHEMBL7437791 0.79 PDE4B (0.89) PDE4BPDE4APDE4CPDE4D
SCHEMBL7341550 0.78 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL7440927 0.78 PDE4B (0.76) PDE4BPDE4APDE4CPDE4D
SCHEMBL7431229 0.77 PDE4B (0.76) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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