SCHEMBL7315202

SCHEMBL7315202

CCCCCCN(C(=O)CCCOc1cccc2c1N=C(NC(=O)OCc1ccccc1)N(CC(=O)NCC(C)(C)C)C2)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.37
PDE4B Q07343 8/20 0.37
PDE4C Q08493 8/20 0.37
PDE4D Q08499 8/20 0.37
PDE3B Q13370 8/20 0.33
PDE3A Q14432 8/20 0.33
FKBP1A P62942 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32

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
SCHEMBL7317876 0.91 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7317363 0.91 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7307586 0.91 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7318037 0.86 PDE4A (0.43) PDE4APDE4BPDE4CPDE4D
SCHEMBL7317212 0.83 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7319503 0.82 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7319495 0.82 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7315017 0.80 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10649567 0.79 PDE4A (0.44) PDE4APDE4BPDE4CPDE4D
SCHEMBL10651441 0.79 PDE4A (0.45) 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