Phenyl Ethanol

Phenyl Ethanol

SCHEMBL11023871

CC(C)OC(C)C.CC(O)c1ccccc1

nearest known ligand 0.46

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.46
ADRA2C P18825 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ADRA2A P08913 1/20 0.46
HIF1A Q16665 1/20 0.46
ALDH1A1 P00352 3/20 0.45
UGT2B7 P16662 1/20 0.43
CHRM2 P08172 1/20 0.43
ADRA1A P35348 1/20 0.43
RGS12 O14924 1/20 0.43
GLA P06280 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
PKM P14618 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
ALOX12 P18054 1/20 0.43
NFKB1 P19838 1/20 0.43
HTR2A P28223 1/20 0.43

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
Phenyl Ethanol SCHEMBL8075664 0.87 LMNA (0.56) LMNAADRA2CKDM4EADRA2AHIF1A
Phenyl Ethanol SCHEMBL2165 0.87
Phenyl Ethanol SCHEMBL32685157 0.87
Phenyl Ethanol SCHEMBL7144 0.87
Phenyl Ethanol SCHEMBL2164 0.87
Phenyl Ethanol SCHEMBL11249656 0.85 LMNA (0.50) LMNAADRA2CKDM4EADRA2AHIF1A
Phenyl Ethanol SCHEMBL28820854 0.85 LMNA (0.50) LMNAADRA2CKDM4EADRA2AHIF1A
Phenyl Ethanol SCHEMBL18582663 0.85 LMNA (0.54) LMNAADRA2CKDM4EADRA2AHIF1A
Phenyl Ethanol SCHEMBL9387700 0.85 LMNA (0.54) LMNAADRA2CKDM4EADRA2AHIF1A
Phenyl Ethanol SCHEMBL3964137 0.85 LMNA (0.54) LMNAADRA2CKDM4EADRA2AHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0049120-B1 PHENETHYLETHER DERIVATIVES, PROCESS FOR PREPARING SAME AND USES THEREOF IN COMBATTING TOBACCO BEETLES AND IN AUGMENTING OR ENHANCING THE AROMA OF PERFUMES, COLOGNES AND PERFUMED ARTICLES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-01-16 EP disclosed
US-4357319-A INSECTICIDES, ATTRACTANTS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-11-02 US disclosed
US-4328206-A Method of attracting and destroying tobacco beetles with alkyl phenethylethers INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-05-04 US disclosed
EP-0049120-A1 Phenethylether derivatives, process for preparing same and uses thereof in combatting tobacco beetles and in augmenting or enhancing the aroma of perfumes, colognes and perfumed articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-04-07 EP disclosed