SCHEMBL8320533

SCHEMBL8320533

C=C(C)Nc1cc(C(=CC#N)c2ccc(OC)c(OC)c2)ccc1OC

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 20/20 0.70
▸ PDE4B Q07343 20/20 0.70
▸ PDE4C Q08493 20/20 0.70
▸ PDE4D Q08499 20/20 0.70

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
SCHEMBL8268687 0.90 PDE4A (0.64) PDE4APDE4BPDE4CPDE4D
SCHEMBL4823813 0.88 PDE4A (0.70) PDE4APDE4BPDE4CPDE4D
SCHEMBL8313787 0.88 PDE4A (0.70) PDE4APDE4BPDE4CPDE4D
SCHEMBL4823814 0.88 PDE4A (0.70) PDE4APDE4BPDE4CPDE4D
SCHEMBL825369 0.84 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL4820946 0.79 PDE4A (0.81) PDE4APDE4BPDE4CPDE4D
SCHEMBL4820951 0.79 PDE4A (0.81) PDE4APDE4BPDE4CPDE4D
SCHEMBL8313280 0.79 PDE4A (0.81) PDE4APDE4BPDE4CPDE4D
SCHEMBL8315588 0.78 PDE4A (0.64) PDE4APDE4BPDE4CPDE4D
SCHEMBL8313277 0.78 PDE4A (0.67) PDE4APDE4BPDE4CPDE4D

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
WO-2004078144-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2004-09-16 — — WO disclosed
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