Benzylphenylether

Benzylphenylether

SCHEMBL28061795

CC#N.c1ccc(COc2ccccc2)cc1

nearest known ligand 0.69

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.69
GAA P10253 1/20 0.62
MAPT P10636 1/20 0.62
MAOA P21397 1/20 0.62
RAB9A P51151 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
PTGS1 P23219 1/20 0.59
SLC6A2 P23975 1/20 0.59
CYP2C19 P33261 1/20 0.59
PTGS2 P35354 1/20 0.59
SLC6A3 Q01959 1/20 0.59
HIF1A Q16665 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
APP P05067 1/20 0.57
BCHE P06276 1/20 0.53
NR4A2 P43354 2/20 0.52
NR4A1 P22736 1/20 0.52

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
Benzylphenylether SCHEMBL27762453 0.89 MAOB (0.71) MAOBGAAMAPTMAOARAB9A
Benzylphenylether SCHEMBL28100345 0.89 LMNA (0.71) MAOBGAAMAPTMAOARAB9A
Acetonitrile SCHEMBL10710304 0.87 MAOB (0.64) MAOBGAAMAPTMAOARAB9A
Benzylphenylether SCHEMBL28256345 0.87 LMNA (0.68) MAOBGAAMAPTMAOARAB9A
Benzylphenylether SCHEMBL61660 0.87 LMNA (0.74) MAOBGAAMAPTMAOARAB9A
Benzylphenylether SCHEMBL10872821 0.85 LMNA (0.72) MAOBGAAMAPTMAOARAB9A
Benzylphenylether SCHEMBL27772467 0.85 MAOB (0.69) MAOBGAAMAPTMAOARAB9A
Benzylphenylether SCHEMBL23235842 0.84 LMNA (0.71) MAOBGAAMAPTMAOARAB9A
Benzylphenylether SCHEMBL8019776 0.84 LMNA (0.71) MAOBGAAMAPTMAOARAB9A
Benzylphenylether SCHEMBL9549322 0.84 LMNA (0.71) MAOBGAAMAPTMAOARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105601522-A Method for industrially synthesizing desvenlafaxine UNIV HEBEI SCIENCE & TECH 2016-05-25 CN claimed
CN-106349105-B A kind of preparation method of benzyl cyanide 河北诚信集团有限公司 2018-11-27 CN disclosed
CN-105601522-A Method for industrially synthesizing desvenlafaxine UNIV HEBEI SCIENCE & TECH 2016-05-25 CN disclosed