Triethylene Glycol

Triethylene Glycol

SCHEMBL1361572

CCCCCCCCC=CCCCCCCCCN1CC(C(=O)O)CC1=O.CCCCCCCCC=CCCCCCCCCN1CC(C(=O)O)CC1=O.OCCOCCOCCO

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP2C19 P33261 2/20 0.39
CNR2 P34972 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
MGLL Q99685 3/20 0.38
FAAH O00519 1/20 0.38
HTT P42858 2/20 0.37
THRB P10828 1/20 0.37
MAPT P10636 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
RECQL P46063 1/20 0.37

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
SCHEMBL2890329 0.94 L3MBTL1 (0.39) EPHX2L3MBTL1SMN1; SMN2POLBMEN1
SCHEMBL2890322 0.94 L3MBTL1 (0.39) EPHX2L3MBTL1SMN1; SMN2POLBMEN1
SCHEMBL1360713 0.90 POLB (0.49) L3MBTL1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL688297 0.90 POLB (0.49) L3MBTL1SMN1; SMN2POLBMEN1KMT2A
Monoethanolamine SCHEMBL2889305 0.88 L3MBTL1 (0.43) L3MBTL1SMN1; SMN2POLBMEN1KMT2A
Glycerin SCHEMBL3844851 0.85 POLB (0.45) L3MBTL1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL1361571 0.85 L3MBTL1 (0.42) EPHX2L3MBTL1MEN1KMT2ACYP2C19
SCHEMBL2889307 0.84 POLB (0.49) L3MBTL1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL15082397 0.83 L3MBTL1 (0.51) L3MBTL1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL15082390 0.83 POLB (0.48) L3MBTL1SMN1; SMN2POLBKMT2ACYP2C19

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-8067651-B2 1-alkyl-5-oxopyrrolidine-3-carboxylic esters with improved biodegradability CLARIANT FINANCE (BVI) LIMITED (VG) 2011-11-29 US disclosed
US-20090043146-A1 1-Alkyl-5-oxopyrrolidine-3-carboxylic esters with improved biodegradability CLARIANT INTERNATIONAL LTD. 2009-02-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090043146-A1 1-Alkyl-5-oxopyrrolidine-3-carboxylic esters with improved biodegradability OXER1, CYP1A1, CHRM1 EPHX2 1095/4885L3MBTL1 3078/4885SMN1; SMN2 3788/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.