SCHEMBL13849064

SCHEMBL13849064

Cc1ccc(OCc2cccc(-c3cc(C(C)C)cc4cccnc34)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.58
PDE4B Q07343 20/20 0.58
PDE4C Q08493 20/20 0.58
PDE4D Q08499 20/20 0.58
PDE5A O76074 1/20 0.47

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
SCHEMBL4041242 0.89 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL4046019 0.89 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL13849076 0.88 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL4045212 0.87 PDE4A (0.66) PDE4APDE4BPDE4CPDE4D
SCHEMBL4042110 0.87 PDE4A (0.64) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL13849024 0.85 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL4035749 0.85 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL4371892 0.85 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL4037709 0.83 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL4027089 0.81 PDE4A (0.62) 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
EP-1487797-B1 HETERO-BRIDGE SUBSTITUTED 8-ARYLQUINOLINE PDE4 INHIBITORS MERCK FROSST CANADA LTD (CA) 2009-05-27 EP disclosed