Triethylene Glycol

Triethylene Glycol

SCHEMBL9233333

CC=C(C)C(=O)Oc1ccc(C(C)(C)c2ccc(O)cc2)cc1.OCCOCCOCCO

nearest known ligand 0.39

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.39
ESR2 Q92731 3/20 0.39
CYP3A4 P08684 3/20 0.39
AR P10275 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
HTR6 P50406 1/20 0.39
ESRRG P62508 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ELANE P08246 3/20 0.36
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 5/20 0.36
POLB P06746 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
BCHE P06276 1/20 0.35

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
SCHEMBL934478 0.88 ESR1 (0.50) ESR1ESR2CYP3A4ARHPGD
SCHEMBL7457186 0.88 ESR1 (0.50) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL9233331 0.88 ESR1 (0.41) ESR1ESR2CYP3A4ARHPGD
Bisphenol A SCHEMBL9233341 0.85 ESR1 (0.43) ESR1ESR2CYP3A4ARHPGD
SCHEMBL7457988 0.78 ELANE (0.44) ESR1ESR2ELANEKDM4EALDH1A1
SCHEMBL215942 0.78 ELANE (0.44) ESR1ESR2ELANEKDM4EALDH1A1
Bisphenol A SCHEMBL9185720 0.78 ESR1 (0.64) ESR1ESR2CYP3A4ARHPGD
SCHEMBL11176645 0.77 APP (0.51) ESR1ESR2CYP3A4ARHPGD
SCHEMBL12516039 0.77 APP (0.51) ESR1ESR2CYP3A4ARHPGD
SCHEMBL3863686 0.77 ESR1 (0.43) ESR1ESR2CYP3A4ARHPGD

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
EP-0658812-A1 Process for the preparation of a printing screen Schablonentechnik Kufstein Aktiengesellschaft (AT) 1995-06-21 EP disclosed