Triethylene Glycol

Triethylene Glycol

SCHEMBL7195508

C=C(C)C.OCCOCCOCCO

nearest known ligand 0.69

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Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.69
KMT2A Q03164 5/20 0.69
TSHR P16473 2/20 0.62
MAPK1 P28482 2/20 0.62
THRB P10828 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HTT P42858 1/20 0.50
MAPT P10636 1/20 0.50
APP P05067 5/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
CASP1 P29466 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SLCO1B3 Q9NPD5 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32

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
Triethylene Glycol SCHEMBL9802787 0.97 MEN1 (0.65) MEN1KMT2ATSHRMAPK1THRB
Triethylene Glycol SCHEMBL1155637 0.86 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
Tetraethylene Glycol SCHEMBL19468343 0.86 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
Di(Hydroxyethyl)Ether SCHEMBL8151639 0.85 TSHR (0.59) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL19468345 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL8072378 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL18843006 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL8076735 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL1155425 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
Hexaethylene Glycol SCHEMBL28265392 0.83 MEN1 (0.85) MEN1KMT2ATSHRMAPK1THRB

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
US-6579836-B1 Anion-active and/or non-ionic tensides, aromatic carboxylic acids, glycol ether, hydrotropic agents and oxygen donors MENNO CHEMIE VERTRIEBSGES, MBH (DE) 2003-06-17 US claimed
US-6579836-B1 Anion-active and/or non-ionic tensides, aromatic carboxylic acids, glycol ether, hydrotropic agents and oxygen donors MENNO CHEMIE VERTRIEBSGES, MBH (DE) 2003-06-17 US disclosed