SCHEMBL6693484

SCHEMBL6693484

COc1ccc(C2=NN(C3CCN(Cc4ccccn4)CC3)C(=O)C3CC=CCC23)cc1OC

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 19/20 0.66
PDE4B Q07343 13/20 0.66
PDE4A P27815 12/20 0.66
PDE4C Q08493 12/20 0.66

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
SCHEMBL2881689 1.00 PDE4D (0.66) PDE4DPDE4BPDE4APDE4C
Hydrochloric Acid SCHEMBL4011686 0.99 PDE4D (0.65) PDE4DPDE4BPDE4APDE4C
SCHEMBL7163938 0.85 PDE4D (0.69) PDE4DPDE4BPDE4APDE4C
SCHEMBL2880752 0.85 PDE4D (0.69) PDE4DPDE4BPDE4APDE4C
SCHEMBL2882127 0.84 PDE4D (0.81) PDE4DPDE4BPDE4APDE4C
SCHEMBL5875868 0.84 PDE4D (0.81) PDE4DPDE4BPDE4APDE4C
SCHEMBL7055996 0.84 PDE4D (0.65) PDE4DPDE4BPDE4APDE4C
SCHEMBL2887989 0.84 PDE4D (0.65) PDE4DPDE4BPDE4APDE4C
SCHEMBL7146863 0.84 PDE4D (0.79) PDE4DPDE4BPDE4APDE4C
SCHEMBL7146867 0.84 PDE4D (0.79) PDE4DPDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004098605-A1 PHARMACEUTICAL COMPOSITION COMPRISING A PDE4 INHIBITOR AND IL-1 TRAP ALTANA PHARMA AG (DE) 2004-11-18 WO disclosed