SCHEMBL6286337

SCHEMBL6286337

COc1ccc(C2=NN(C3CCN(C(=O)NC(C)(C)C)CC3)C(=O)C3CC=CCC23)cc1OC

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 18/20 0.68
PDE4B Q07343 12/20 0.68
PDE4A P27815 11/20 0.68
PDE4C Q08493 11/20 0.68
PDE7B Q9NP56 1/20 0.61

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
SCHEMBL2887789 1.00 PDE4D (0.68) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL5875876 0.89 PDE4D (0.57) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL2888335 0.89 PDE4D (0.57) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6489896 0.87 PDE4D (0.61) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6479899 0.86 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6479903 0.84 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6485190 0.84 PDE4D (0.71) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL5553386 0.84 PDE4D (0.78) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6485199 0.84 PDE4D (0.71) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6256486 0.83 PDE7B (0.85) PDE4DPDE4BPDE4APDE4CPDE7B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005023253-A1 USE OF PDE4 INHIBITORS FOR THE TREATMENT OF DIABETES MELLITUS ALTANA PHARMA AG (DE) 2005-03-17 WO claimed
WO-2004098578-A2 COMPOSITION COMPRISING A PDE4 INHIBITOR AND A TNF-ALFA ANTAGONIST SELECTED FROM INFLIXIMAB, ADALIMUMAB, CDP870 AND CDP517 ALTANA PHARMA AG (DE) 2004-11-18 WO claimed
EP-1587512-A2 PDE4 INHIBITORS FOR THE TREATMENT OF NEOPLASMS OF LYMPHOID CELLS ALTANA Pharma AG (DE) 2005-10-26 EP disclosed
WO-2005023253-A1 USE OF PDE4 INHIBITORS FOR THE TREATMENT OF DIABETES MELLITUS ALTANA PHARMA AG (DE) 2005-03-17 WO disclosed
WO-2004062671-A2 PDE4 INHIBITORS FOR THE TREATMENT OF NEOPLASMS OF LYMPHOID CELLS ALTANA PHARMA AG (DE) 2004-07-29 WO disclosed