SCHEMBL7314022

SCHEMBL7314022

CCCCCN(C)C(=O)CCCOc1ccc2c(c1)CN(CC(=O)NN1CCCCC1)C(NC(=O)Cc1ccccc1)=N2

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 15/20 0.49
PDE4B Q07343 15/20 0.49
PDE4C Q08493 15/20 0.49
PDE4D Q08499 15/20 0.49
PDE3B Q13370 5/20 0.46
PDE3A Q14432 5/20 0.46

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
SCHEMBL7321380 0.87 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7311102 0.86 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7307287 0.85 PDE4A (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL7314018 0.83 PDE3B (0.45) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7313335 0.78 PDE4A (0.71) PDE4APDE4BPDE4CPDE4D
SCHEMBL7313102 0.78 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7315628 0.78 PDE4A (0.80) PDE4APDE4BPDE4CPDE4D
SCHEMBL7317132 0.78 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7308427 0.77 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7317688 0.77 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DPDE3B

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