SCHEMBL14577243

SCHEMBL14577243

COC(=O)N1C[C@H](c2ccc(OC)c(OC(C)CCc3ccccc3)c2)[C@@](C)([C@@H](C)O)C1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.49
PDE4A P27815 8/20 0.49
PDE4C Q08493 8/20 0.49
PDE4D Q08499 8/20 0.49
PDE7A Q13946 1/20 0.47
RORC P51449 2/20 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
SCHEMBL14576614 1.00 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL14576477 1.00 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5370658 1.00 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL14575811 1.00 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5370667 1.00 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5370662 1.00 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL14576471 1.00 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL14575551 0.90 PDE4B (0.61) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5370539 0.90 PDE4B (0.61) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL5362362 0.88 PDE4B (0.52) PDE4BPDE4APDE4CPDE4DPDE7A

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-7176229-B2 Cyclic AMP-specific phosphodiesterase inhibitors ICOS CORPORATION (US) 2007-02-13 US disclosed