SCHEMBL7320397

SCHEMBL7320397

CC(OC(=O)CN1Cc2cc(OCCCC(=O)N(C)C3CCCCC3)ccc2N=C1NC(=O)Nc1ccc(N(C)C)cc1)C(C)(C)C

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.72
PDE4B Q07343 20/20 0.72
PDE4C Q08493 20/20 0.72
PDE4D Q08499 20/20 0.72

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
SCHEMBL7309527 0.90 PDE4A (0.79) PDE4APDE4BPDE4CPDE4D
SCHEMBL7320747 0.90 PDE4A (0.79) PDE4APDE4BPDE4CPDE4D
SCHEMBL7315529 0.89 PDE4A (0.64) PDE4APDE4BPDE4CPDE4D
SCHEMBL7310263 0.88 PDE4A (0.76) PDE4APDE4BPDE4CPDE4D
SCHEMBL7310301 0.87 PDE4A (0.75) PDE4APDE4BPDE4CPDE4D
SCHEMBL7308946 0.87 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL7310161 0.85 PDE4A (0.77) PDE4APDE4BPDE4CPDE4D
SCHEMBL7313527 0.84 PDE4A (0.76) PDE4APDE4BPDE4CPDE4D
Bromide SCHEMBL7312935 0.84 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7313376 0.84 PDE4A (1.00) 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