SCHEMBL1434848

SCHEMBL1434848

COc1ccc(C(=O)Cc2c(Cl)cncc2Cl)c(OCc2cccc(C(=O)O)c2)c1OC

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 18/20 0.80
PDE4A P27815 1/20 0.57
PDE4B Q07343 1/20 0.57
PDE4C Q08493 1/20 0.57
MRGPRX4 Q96LA9 2/20 0.52

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
SCHEMBL885300 0.92 PDE4D (0.76) PDE4DPDE4APDE4BPDE4C
SCHEMBL1434376 0.90 PDE4D (0.81) PDE4DPDE4APDE4BPDE4C
SCHEMBL885185 0.89 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL885187 0.89 PDE4D (0.80) PDE4DPDE4APDE4BPDE4C
SCHEMBL885282 0.89 PDE4D (0.80) PDE4DPDE4APDE4BPDE4C
SCHEMBL1434867 0.89 PDE4D (0.83) PDE4DPDE4APDE4BPDE4C
SCHEMBL885123 0.85 PDE4D (0.75) PDE4DPDE4APDE4BPDE4C
SCHEMBL885277 0.85 PDE4D (0.75) PDE4DPDE4APDE4BPDE4C
SCHEMBL885157 0.85 PDE4D (0.92) PDE4DPDE4APDE4BPDE4C
SCHEMBL885307 0.84 PDE4D (0.79) PDE4DPDE4APDE4BPDE4C

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-2125736-B1 SUBSTITUTED ACETOPHENONES USEFUL AS PDE4 INHIBITORS LEO PHARMA AS (DK) 2011-03-30 EP claimed