SCHEMBL8269871

SCHEMBL8269871

COc1cc(C(=CN)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 2/20 0.59
▸ PDE4B Q07343 2/20 0.59
▸ PDE4C Q08493 2/20 0.59
▸ PDE4D Q08499 2/20 0.59
▸ CYP3A4 P08684 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ ACHE P22303 1/20 0.46
▸ ABCG2 Q9UNQ0 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CA9 Q16790 1/20 0.45
▸ TUBB1 Q9H4B7 3/20 0.45
▸ TUBB4A P04350 2/20 0.45
▸ TUBB P07437 2/20 0.45
▸ TUBA3C P0DPH7 2/20 0.45
▸ TUBA1B P68363 2/20 0.45
▸ TUBA4A P68366 2/20 0.45
▸ TUBB4B P68371 2/20 0.45
▸ TUBB3 Q13509 2/20 0.45

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
SCHEMBL13986032 0.91 PDE4A (0.56) PDE4APDE4BPDE4CPDE4DTUBB1
SCHEMBL8319883 0.89 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL8321041 0.85 TUBB1 (0.64) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL8320626 0.83 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DABCG2
SCHEMBL8320594 0.83 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL8269870 0.78 TUBB1 (0.47) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL4822510 0.75 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL8321025 0.74 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DABCG2
SCHEMBL8270323 0.73 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL8319800 0.73 PDE4A (0.77) 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 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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