SCHEMBL6468543

SCHEMBL6468543

COc1ccc(N(c2ccc(OCC3CCC(=O)N3)cc2)C(O)c2cccnc2)cc1OC1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 13/20 0.44
PDE4B Q07343 4/20 0.44
PDE4C Q08493 4/20 0.44
PDE4D Q08499 4/20 0.44
IRAK4 Q9NWZ3 7/20 0.42

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
SCHEMBL3122580 0.80 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DIRAK4
SCHEMBL6465669 0.76 PDE4A (0.51) PDE4APDE4BPDE4CPDE4D
SCHEMBL6469266 0.76 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL6470116 0.75 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL6527339 0.75 PDE4A (0.47) PDE4APDE4BPDE4CPDE4D
SCHEMBL6470078 0.74 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL6533002 0.72 PDE4A (0.46) PDE4APDE4BPDE4CPDE4D
SCHEMBL1157730 0.69 PDE4A (0.54) PDE4APDE4BPDE4CPDE4D
SCHEMBL3130695 0.69 PDE4A (0.54) PDE4APDE4BPDE4CPDE4D
SCHEMBL3129573 0.68 PDE4A (0.51) PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569908-A2 PYRIDINE N-OXIDE COMPOUNDS AS PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceutical Corporation (US) 2005-09-07 EP disclosed
WO-2004046113-A2 PYRIDINE N-OXIDE COMPOUNDS AS PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-06-03 WO disclosed