Ethylene Glycol

Ethylene Glycol

SCHEMBL11213499

O=C(CBr)OCCOC(=O)CBr.OCCO

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
TRPA1 O75762 2/20 0.52
ALDH1A1 P00352 1/20 0.52
FAAH O00519 2/20 0.36
DGKA P23743 1/20 0.34
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA1A P35348 1/20 0.32
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
NAAA Q02083 1/20 0.30

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
SCHEMBL1434603 0.91 CYP2C19 (0.64) CYP2C19L3MBTL1TRPA1ALDH1A1FAAH
SCHEMBL1887294 0.89
SCHEMBL11528463 0.85 MEN1 (0.50) CYP2C19L3MBTL1TRPA1ALDH1A1FAAH
SCHEMBL11804455 0.84
Glycolic Acid SCHEMBL2390988 0.84 CYP2C19 (0.52) CYP2C19L3MBTL1TRPA1ALDH1A1FAAH
SCHEMBL15616858 0.83 CYP2C19 (0.56) CYP2C19L3MBTL1TRPA1ALDH1A1FAAH
SCHEMBL14273796 0.83 CYP2C19 (0.56) CYP2C19L3MBTL1TRPA1ALDH1A1FAAH
SCHEMBL28704524 0.82 CYP2C19 (0.50) CYP2C19L3MBTL1TRPA1ALDH1A1FAAH
Methoxymethane SCHEMBL10420459 0.82 CYP2C19 (0.56) CYP2C19L3MBTL1TRPA1ALDH1A1FAAH
SCHEMBL21069032 0.80 FAAH (0.48) CYP2C19L3MBTL1TRPA1ALDH1A1FAAH

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
US-4330376-A RHODIUM COATING ATLANTIC RICHFIELD COMPANY (US) 1982-05-18 US disclosed
US-4238551-A RHODIUM COATING, ACID RESISTANCE HALCON RESEARCH & DEVELOPMENT CORPORATION (US) 1980-12-09 US disclosed
US-4153806-A Recovery of vicinal glycol esters by plural stage distillation HALCON RESEARCH AND DEVELOPMENT CORP. (US) 1979-05-08 US disclosed