SCHEMBL7366062

SCHEMBL7366062

COC(=O)c1ccc(CN2CC(c3ccc(OC)c(OC4CCCC4)c3)CC2=O)cc1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.77
PDE4A P27815 11/20 0.77
PDE4C Q08493 6/20 0.77
PDE4D Q08499 6/20 0.77

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
SCHEMBL7367793 0.92 PDE4A (0.81) PDE4BPDE4APDE4CPDE4D
SCHEMBL7366137 0.89 PDE4B (0.77) PDE4BPDE4APDE4CPDE4D
SCHEMBL7362857 0.89 PDE4B (0.74) PDE4BPDE4APDE4CPDE4D
SCHEMBL7366141 0.89 PDE4B (0.80) PDE4BPDE4APDE4CPDE4D
SCHEMBL7365946 0.89 PDE4B (0.82) PDE4BPDE4APDE4CPDE4D
SCHEMBL7399863 0.88 PDE4B (0.78) PDE4BPDE4APDE4CPDE4D
SCHEMBL3547495 0.88 PDE4A (0.84) PDE4BPDE4APDE4CPDE4D
SCHEMBL5222151 0.88 PDE4A (0.84) PDE4BPDE4APDE4CPDE4D
SCHEMBL3547968 0.88 PDE4A (0.84) PDE4BPDE4APDE4CPDE4D
SCHEMBL7448224 0.88 PDE4A (0.83) 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
EP-0584208-A4 1994-03-23 EP claimed
EP-0584208-A1 PYRROLIDINONES SMITHKLINE BEECHAM CORPORATION (US) 1994-03-02 EP claimed
WO-1992019594-A1 PYRROLIDINONES SMITHKLINE BEECHAM CORPORATION (US) 1992-11-12 WO claimed
EP-0584208-A4 1994-03-23 EP disclosed
EP-0584208-A1 PYRROLIDINONES SMITHKLINE BEECHAM CORPORATION (US) 1994-03-02 EP disclosed
WO-1992019594-A1 PYRROLIDINONES SMITHKLINE BEECHAM CORPORATION (US) 1992-11-12 WO disclosed