SCHEMBL7307540

SCHEMBL7307540

CCCCCCN(C(=O)CCCOc1ccc2c(c1)CN(CC(=O)OCC(C)(C)C)C(N)=N2)C1CCCCC1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.78
PDE4B Q07343 20/20 0.78
PDE4C Q08493 20/20 0.78
PDE4D Q08499 20/20 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
SCHEMBL10671043 0.91 PDE4A (0.69) PDE4APDE4BPDE4CPDE4D
SCHEMBL10651713 0.90 PDE4A (0.67) PDE4APDE4BPDE4CPDE4D
SCHEMBL10669636 0.90 PDE4A (0.75) PDE4APDE4BPDE4CPDE4D
SCHEMBL7319578 0.88 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7315156 0.88 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL10652077 0.87 PDE4A (0.79) PDE4APDE4BPDE4CPDE4D
SCHEMBL7318109 0.86 PDE4A (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL10672380 0.85 PDE4A (0.67) PDE4APDE4BPDE4CPDE4D
SCHEMBL7320328 0.85 PDE4A (0.67) PDE4APDE4BPDE4CPDE4D
SCHEMBL7310357 0.85 PDE4A (0.57) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4739056-A ENZYME INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-04-19 US disclosed