SCHEMBL9325839

SCHEMBL9325839

COc1ccc([C@H]2CC[C@H](O)C2)cc1OC1CCCC1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.71
PDE4A P27815 5/20 0.71
PDE4C Q08493 5/20 0.71
PDE4D Q08499 5/20 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
SCHEMBL9325314 1.00 PDE4B (0.71) PDE4BPDE4APDE4CPDE4D
SCHEMBL9325842 1.00 PDE4B (0.71) PDE4BPDE4APDE4CPDE4D
SCHEMBL9325318 1.00 PDE4B (0.71) PDE4BPDE4APDE4CPDE4D
SCHEMBL9325330 1.00 PDE4B (0.71) PDE4BPDE4APDE4CPDE4D
SCHEMBL9327384 0.86 PDE4B (0.67) PDE4BPDE4APDE4CPDE4D
SCHEMBL9327374 0.86 PDE4B (0.67) PDE4BPDE4APDE4CPDE4D
SCHEMBL9327377 0.86 PDE4B (0.67) PDE4BPDE4APDE4CPDE4D
SCHEMBL9167416 0.85 PDE4B (0.78) PDE4BPDE4APDE4CPDE4D
SCHEMBL7364134 0.85 PDE4B (0.66) PDE4BPDE4APDE4CPDE4D
SCHEMBL9062953 0.84 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5362915-A Inhibitors of enzymes/hydrolases; antiallergens, antiinflammatory agents SMITHKLINE BEECHAM PHARMA GMBH (DE) 1994-11-08 US claimed
EP-0523138-A1 NOVEL DERIVATIVES OF PHENYL-CYCLOALKANES AND -CYCLOALKENES SMITHKLINE BEECHAM PHARMA GmbH (DE) 1993-01-20 EP claimed
WO-1991015451-A1 NOVEL DERIVATIVES OF PHENYL-CYCLOALKANES AND -CYCLOALKENES SMITHKLINE BEECHAM PHARMA GMBH (DE) 1991-10-17 WO claimed
US-5362915-A Inhibitors of enzymes/hydrolases; antiallergens, antiinflammatory agents SMITHKLINE BEECHAM PHARMA GMBH (DE) 1994-11-08 US disclosed
EP-0523138-A1 NOVEL DERIVATIVES OF PHENYL-CYCLOALKANES AND -CYCLOALKENES SMITHKLINE BEECHAM PHARMA GmbH (DE) 1993-01-20 EP disclosed
WO-1991015451-A1 NOVEL DERIVATIVES OF PHENYL-CYCLOALKANES AND -CYCLOALKENES SMITHKLINE BEECHAM PHARMA GMBH (DE) 1991-10-17 WO disclosed