SCHEMBL3120254

SCHEMBL3120254

COc1ccc(C(CC(=O)O)N2C(=O)c3ccc(C)cc3C2=O)cc1OC1CCCC1

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 11/20 0.82
PDE4B Q07343 11/20 0.82
PDE4C Q08493 11/20 0.82
PDE4D Q08499 11/20 0.82
TNF P01375 11/20 0.62

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
SCHEMBL4852155 0.91 PDE4A (0.68) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL4637167 0.91 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL4858344 0.90 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL4637688 0.90 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL5905132 0.88 PDE4A (0.87) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL3122947 0.87 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL4914687 0.87 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL6098315 0.87 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL3122955 0.86 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL3127722 0.85 PDE4A (0.83) PDE4APDE4BPDE4CPDE4DTNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1510518-B1 Substituted 1,3,4-oxadiazoles for use in the treatement or prophylaxis of diseases CELGENE CORP (US) 2010-12-01 EP disclosed
EP-1462449-B9 Substituted 1,3,4-oxadiazoles and a method of reducing TNF-alpha levels CELGENE CORP (US) 2010-03-10 EP disclosed
EP-1462449-B1 Substituted 1,3,4-oxadiazoles and a method of reducing TNF-alpha levels CELGENE CORP (US) 2009-09-02 EP disclosed
EP-1510518-A2 Substituted 1,3,4-oxadiazoles and a method of reducing TNF-alpha levels CELGENE CORPORATION (US) 2005-03-02 EP disclosed
EP-1242413-B1 SUBSTITUTED 1,3,4-OXADIAZOLES AND A METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORP (US) 2004-11-17 EP disclosed
EP-1462449-A1 Substituted 1,3,4-oxadiazoles and a method of reducing TNF-alpha levels CELGENE CORPORATION (US) 2004-09-29 EP disclosed
EP-1412364-A1 PLATELET ADP RECEPTOR INHIBITORS Portola Pharmaceuticals, Inc. (US) 2004-04-28 EP disclosed
EP-1242413-A4 SUBSTITUTED 1,3,4-OXADIAZOLES AND A METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORP (US) 2003-04-23 EP disclosed
WO-2003011872-A1 PLATELET ADP RECEPTOR INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-02-13 WO disclosed
EP-1242413-A1 SUBSTITUTED 1,3,4-OXADIAZOLES AND A METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORPORATION (US) 2002-09-25 EP disclosed
US-6326388-B1 ANTIINFLAMMATORY AGENTS CELGENE CORPORATION 2001-12-04 US disclosed
WO-2001046183-A1 SUBSTITUTED 1,3,4-OXADIAZOLES AND A METHOD OF REDUCING TNF-α LEVELS CELGENE CORPORATION (US) 2001-06-28 WO disclosed