SCHEMBL1435448

SCHEMBL1435448

CCCNC(=O)COc1c(C(=O)Cc2ccncc2Cl)ccc(OC)c1OC

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 20/20 0.78
PDE4A P27815 1/20 0.78
PDE4B Q07343 1/20 0.78
PDE4C Q08493 1/20 0.78

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
SCHEMBL885281 0.89 PDE4D (0.67) PDE4DPDE4APDE4BPDE4C
SCHEMBL885153 0.88 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL29373051 0.88 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL15544770 0.86 PDE4D (0.68) PDE4DPDE4APDE4BPDE4C
SCHEMBL1434520 0.85 PDE4D (0.78) PDE4DPDE4APDE4BPDE4C
SCHEMBL885194 0.84 PDE4D (0.71) PDE4DPDE4APDE4BPDE4C
SCHEMBL885249 0.84 PDE4D (0.68) PDE4DPDE4APDE4BPDE4C
SCHEMBL885321 0.84 PDE4D (0.70) PDE4DPDE4APDE4BPDE4C
SCHEMBL14480187 0.83 PDE4D (0.69) PDE4DPDE4APDE4BPDE4C
SCHEMBL885280 0.82 PDE4D (0.89) 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