Di(Hydroxyethyl)Ether

Di(Hydroxyethyl)Ether

SCHEMBL9561716

CC(C)C(=O)O.CC(C)C(=O)O.OCCOCCO

nearest known ligand 0.53

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Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
MAPK1 P28482 1/20 0.53
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 1/20 0.43
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
TP53 P04637 1/20 0.36
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
RNPEP Q9H4A4 1/20 0.32
CYP1A2 P05177 1/20 0.32
SLC7A5 Q01650 1/20 0.32
GABRR1 P24046 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 SCHEMBL2213080 0.97 MEN1 (0.55) TSHRMAPK1MEN1KMT2AALDH1A1
Tetraethylene Glycol SCHEMBL7637829 0.97 MEN1 (0.55) TSHRMAPK1MEN1KMT2AALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL4577033 0.91 TSHR (0.43) TSHRMAPK1MEN1KMT2AALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL28174751 0.87 TP53 (0.55) TSHRMAPK1MEN1KMT2AALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL29124601 0.85 TSHR (0.48) TSHRMAPK1MEN1KMT2AALDH1A1
Tetraethylene Glycol SCHEMBL1052486 0.85 MEN1 (0.52) TSHRMAPK1MEN1KMT2AALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL29239546 0.85 TSHR (0.48) TSHRMAPK1MEN1KMT2AALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL1171068 0.85 TSHR (0.48) TSHRMAPK1MEN1KMT2AALDH1A1
Triethylene Glycol SCHEMBL14964597 0.83 MEN1 (0.50) TSHRMAPK1MEN1KMT2AALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL3737012 0.81 TSHR (0.43) TSHRMAPK1MEN1KMT2AALDH1A1

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
CN-114206483-A Hollow fiber membrane 路博润先进材料公司 2022-03-18 CN disclosed
CN-112334216-A Flat porous PVC film 路博润先进材料公司 2021-02-05 CN disclosed
US-5196136-A Cleaning composition of hydrocarbon component, surfactant and multibasic ester additive E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-03-23 US disclosed
EP-0041779-A1 Colouration process IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-12-16 EP disclosed