SCHEMBL7361038

SCHEMBL7361038

COC(=O)N1CC(c2ccc(OC)c(OCCCc3ccccc3)c2)C(C)([C@H](C)O)C1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.51
PDE4A P27815 7/20 0.49
PDE4C Q08493 7/20 0.49
PDE4D Q08499 7/20 0.49
PDE7A Q13946 1/20 0.47
RORC P51449 1/20 0.41

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
SCHEMBL5356884 1.00 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL14577351 1.00 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5357639 1.00 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL7353466 0.97 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5355265 0.97 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5362298 0.97 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5360454 0.95 PDE4B (0.52) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5362362 0.95 PDE4B (0.52) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5755814 0.93 PDE4B (0.53) PDE4BPDE4APDE4CPDE4D
SCHEMBL5755588 0.93 PDE4B (0.53) PDE4BPDE4APDE4CPDE4D

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-6258833-B1 ENZYME INHIBITORS AND ANTIINFLAMMATORY AGENTS ICOS CORPORATION 2001-07-10 US disclosed