SCHEMBL6256486

SCHEMBL6256486

COc1ccc(C2=NN(C3CCN(C(=O)N4CCOCC4)CC3)C(=O)C3CC=CCC23)cc1OC

nearest known ligand 0.85

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE7B Q9NP56 1/20 0.85
PDE4D Q08499 18/20 0.78
PDE4B Q07343 12/20 0.78
PDE4A P27815 11/20 0.78
PDE4C Q08493 11/20 0.78

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
SCHEMBL2887652 1.00 PDE7B (0.85) PDE7BPDE4DPDE4BPDE4APDE4C
SCHEMBL5564655 0.92 PDE7B (1.00) PDE7BPDE4DPDE4BPDE4APDE4C
SCHEMBL5564653 0.92 PDE7B (1.00) PDE7BPDE4DPDE4BPDE4APDE4C
SCHEMBL5564651 0.92 PDE7B (1.00) PDE7BPDE4DPDE4BPDE4APDE4C
SCHEMBL2886831 0.89 PDE4D (0.74) PDE7BPDE4DPDE4BPDE4APDE4C
SCHEMBL6467291 0.89 PDE4D (0.74) PDE7BPDE4DPDE4BPDE4APDE4C
SCHEMBL2887808 0.89 PDE7B (0.73) PDE7BPDE4DPDE4BPDE4APDE4C
SCHEMBL5528256 0.89 PDE7B (0.73) PDE7BPDE4DPDE4BPDE4APDE4C
Hydrochloric Acid SCHEMBL4018156 0.88 PDE4D (0.73) PDE7BPDE4DPDE4BPDE4APDE4C
SCHEMBL7142486 0.88 PDE4B (1.00) PDE7BPDE4DPDE4BPDE4APDE4C

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
WO-2005023253-A1 USE OF PDE4 INHIBITORS FOR THE TREATMENT OF DIABETES MELLITUS ALTANA PHARMA AG (DE) 2005-03-17 WO claimed
US-6953853-B2 Phospholipase inhbitors; antiinflammatory agents; respiratory system disorders ALTANA PHARMA AG (DE) 2005-10-11 US disclosed