SCHEMBL8269329

SCHEMBL8269329

COc1cccc(C(=CN)c2ccc(OC)c(OC)c2)c1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 16/20 0.70
▸ PDE4B Q07343 16/20 0.70
▸ PDE4C Q08493 16/20 0.70
▸ PDE4D Q08499 16/20 0.70
▸ PARP1 P09874 1/20 0.53
▸ PRSS1 P07477 1/20 0.53
▸ PRSS2 P07478 1/20 0.53
▸ PRSS3 P35030 1/20 0.53
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ NQO2 P16083 1/20 0.49

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
SCHEMBL8269868 0.89 PARP1 (0.59) PDE4APDE4BPDE4CPDE4DPARP1
SCHEMBL8319800 0.88 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DNQO2
SCHEMBL8270543 0.88 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DPARP1
SCHEMBL8269338 0.86 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DRAB9A
SCHEMBL8269334 0.84 PDE4A (0.67) PDE4APDE4BPDE4CPDE4DPARP1
SCHEMBL4824255 0.82 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL4824248 0.82 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL4824157 0.80 CYP1A2 (0.73) PDE4APDE4BPDE4CPDE4DPARP1
SCHEMBL8320190 0.80 PDE4A (0.62) PDE4APDE4BPDE4CPDE4D
SCHEMBL8319883 0.80 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DNQO2

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
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