Benzylphenylether

Benzylphenylether

SCHEMBL9549322

N.c1ccc(COc2ccccc2)cc1

nearest known ligand 0.85

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.71
CYP1A2 P05177 1/20 0.71
PTGS1 P23219 1/20 0.71
SLC6A2 P23975 1/20 0.71
CYP2C19 P33261 1/20 0.71
PTGS2 P35354 1/20 0.71
SLC6A3 Q01959 1/20 0.71
HIF1A Q16665 1/20 0.71
HDAC6 Q9UBN7 1/20 0.71
MAOB P27338 7/20 0.68
APP P05067 1/20 0.68
GAA P10253 1/20 0.68
MAPT P10636 1/20 0.68
MAOA P21397 1/20 0.68
RAB9A P51151 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
BCHE P06276 1/20 0.63
NR4A1 P22736 1/20 0.61
NR4A2 P43354 1/20 0.61

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 SCHEMBL61660 0.97 LMNA (0.74) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL8019776 0.95 LMNA (0.71) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL27439928 0.95 LMNA (0.71) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL28100345 0.95 LMNA (0.71) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL9283359 0.95 LMNA (0.71) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL23235842 0.95 LMNA (0.71) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL10609652 0.92 LMNA (0.75) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL22499954 0.92 LMNA (0.68) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL28256345 0.92 LMNA (0.68) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL850999 0.92 APP (0.78) LMNACYP1A2PTGS1SLC6A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101595084-B Diaryl compositions and methods for modulating kinase cascades KINEX PHARMACEUTICALS LLC US 2013-01-02 CN disclosed
CN-101595084-A Diaryl compositions and methods for modulating kinase cascades KINEX PHARMACEUTICALS LLC (US) 2009-12-02 CN disclosed
EP-0288515-B1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS ISP INVESTMENTS INC. (US) 1993-05-05 EP disclosed
EP-0288515-A4 QUATERNIZED NITROGEN CONTAINING COMPOUNDS 1990-09-26 EP disclosed
US-4830850-A CONDITIONERS, SOFTENERS, PRESERVATIVES GAF CORPORATION (US) 1989-05-16 US disclosed
EP-0288515-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS. GAF CORP (US) 1988-11-02 EP disclosed
WO-1988002985-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS GAF CORPORATION (US) 1988-05-05 WO disclosed