Triethylene Glycol

Triethylene Glycol

SCHEMBL8995564

NC(=O)CCCCC(N)=O.OCCOCCOCCO

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
TSHR P16473 3/20 0.50
MAPK1 P28482 1/20 0.50
GAA P10253 1/20 0.44
THRB P10828 1/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 2/20 0.36
EPHX2 P34913 1/20 0.35
SOAT1 P35610 2/20 0.34
FAAH O00519 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
GPR84 Q9NQS5 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL22266259 0.95 KMT2A (0.50) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL8263454 0.93 MEN1 (0.54) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL28674740 0.93 MEN1 (0.52) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL22266235 0.93 GAA (0.52) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL22266293 0.91 GAA (0.55) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL8881923 0.91 GAA (0.55) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL8883206 0.90 TSHR (0.50) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL13428944 0.90 KMT2A (0.55) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL22047444 0.90 KMT2A (0.55) MEN1KMT2ATSHRMAPK1GAA
SCHEMBL27273017 0.90 KMT2A (0.55) MEN1KMT2ATSHRMAPK1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0490482-B1 Polyamides from polyetheramines, hexamethylene diamine and adipic acid HUNTSMAN CORP (US) 1996-08-21 EP disclosed
US-5179175-A Impact strength TEXACO CHEMICAL COMPANY (US) 1993-01-12 US disclosed
EP-0490482-A2 Polyamides from polyetheramines, hexamethylene diamine and adipic acid Huntsman Corporation (US) 1992-06-17 EP disclosed