SCHEMBL8269331

SCHEMBL8269331

CC=C(c1cc(OC)cc(OC)c1)c1ccc(OC(F)F)c(OC(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 18/20 0.68
PDE4B Q07343 18/20 0.68
PDE4C Q08493 18/20 0.68
PDE4D Q08499 18/20 0.68
KDM4E B2RXH2 1/20 0.44
HTT P42858 1/20 0.44
NQO2 P16083 1/20 0.40

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
SCHEMBL13985990 0.87 PDE4A (0.71) PDE4APDE4BPDE4CPDE4D
SCHEMBL4821574 0.87 PDE4A (0.71) PDE4APDE4BPDE4CPDE4D
SCHEMBL14189763 0.82 PDE4A (0.65) PDE4APDE4BPDE4CPDE4D
SCHEMBL4816968 0.82 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DNQO2
SCHEMBL4816976 0.82 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DNQO2
SCHEMBL4827006 0.81 ALDH1A1 (0.53) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL4818719 0.76 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DNQO2
SCHEMBL4818725 0.76 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DNQO2
SCHEMBL4819741 0.75 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL4819738 0.75 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006026747-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2006-03-09 WO disclosed
WO-2004078144-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2004-09-16 WO disclosed