SCHEMBL885256

SCHEMBL885256

CCOc1c(OC)ccc(C(C=O)c2c(Cl)cncc2Cl)c1OC

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 16/20 0.53
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KCNH2 Q12809 1/20 0.36

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
SCHEMBL885389 0.96 PDE4D (0.51) PDE4DPDE4APDE4BPDE4CSMN1; SMN2
SCHEMBL885352 0.92 PDE4D (0.45) PDE4DPDE4APDE4BPDE4C
SCHEMBL4434300 0.91 PDE4D (0.45) PDE4DPDE4APDE4BPDE4C
SCHEMBL885392 0.89 PDE4D (0.42) PDE4DPDE4APDE4BPDE4CSMN1; SMN2
SCHEMBL4429229 0.88 PDE4D (0.48) PDE4DPDE4APDE4BPDE4CSMN1; SMN2
SCHEMBL884956 0.87 PDE4D (0.43) PDE4DPDE4APDE4BPDE4C
SCHEMBL885159 0.87 PDE4D (0.53) PDE4DPDE4APDE4BPDE4CSMN1; SMN2
SCHEMBL884882 0.86 PDE4D (0.42) PDE4DPDE4APDE4BPDE4C
SCHEMBL885108 0.85 PDE4D (0.41) PDE4DPDE4APDE4BPDE4C
SCHEMBL885259 0.85 PDE4D (0.40) PDE4DSMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125736-A1 SUBSTITUTED ACETOPHENONES USEFUL AS PDE4 INHIBITORS Leo Pharma A/S (DK) 2009-12-02 EP claimed
WO-2008077404-A1 SUBSTITUTED ACETOPHENONES USEFUL AS PDE4 INHIBITORS LEO PHARMA A/S (DK) 2008-07-03 WO claimed
EP-2125736-A1 SUBSTITUTED ACETOPHENONES USEFUL AS PDE4 INHIBITORS Leo Pharma A/S (DK) 2009-12-02 EP disclosed
WO-2008077404-A1 SUBSTITUTED ACETOPHENONES USEFUL AS PDE4 INHIBITORS LEO PHARMA A/S (DK) 2008-07-03 WO disclosed