SCHEMBL7316342

SCHEMBL7316342

Cc1cc(C)c(COC(=O)CN2Cc3cc(OCCCC(=O)N(C4CCCCC4)C4CCCCC4)ccc3N=C2NC(=O)NC(C)(C)C)c(C)c1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 18/20 0.61
PDE4B Q07343 18/20 0.61
PDE4C Q08493 18/20 0.61
PDE4D Q08499 18/20 0.61
PDE3B Q13370 2/20 0.48
PDE3A Q14432 2/20 0.48

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
SCHEMBL7320546 0.94 PDE4A (0.70) PDE4APDE4BPDE4CPDE4D
SCHEMBL7320501 0.88 PDE4A (0.61) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7318518 0.88 PDE4A (0.61) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7315134 0.86 PDE4A (0.82) PDE4APDE4BPDE4CPDE4D
SCHEMBL7307110 0.86 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL7318122 0.84 PDE4A (0.70) PDE4APDE4BPDE4CPDE4D
SCHEMBL7312538 0.83 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7321342 0.81 PDE4A (0.69) PDE4APDE4BPDE4CPDE4D
SCHEMBL7317776 0.80 PDE4A (0.83) PDE4APDE4BPDE4CPDE4D
SCHEMBL7318141 0.78 PDE4A (0.84) 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