Propylene Glycol

Propylene Glycol

SCHEMBL9893772

CC(O)CO.CC(O)CO.CC(O)CO.CCCOC(=O)C1CCCCC1C(=O)O

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

The experimentally established mechanism targets of Propylene Glycol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.42
PTPN1 P18031 1/20 0.42
PPP1CC P36873 1/20 0.42
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
TAAR1 Q96RJ0 1/20 0.35
ACE P12821 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
Propylene Glycol SCHEMBL9894371 0.92 CHRM2 (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
Propylene Glycol SCHEMBL16653131 0.92 CHRM2 (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1296712 0.89 PPM1B (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
Ethylene Glycol SCHEMBL1297097 0.88 PPM1B (0.46) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL9937392 0.86 TDP1 (0.40) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL14204531 0.86 PPM1B (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL234736 0.82 TP53 (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1245769 0.82 TP53 (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL1245768 0.82 TP53 (0.50) PPM1BPTPN1PPP1CCTP53CYP3A4
Propylene Glycol SCHEMBL16652384 0.81 TAAR1 (0.40) TAAR1ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9771466-B2 Glycol ether-based cyclohexanoate ester plasticizers and blends therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-09-26 US claimed
US-20150112008-A1 Glycol Ether-Based Cyclohexanoate Ester Plasticizers and Blends Therefrom EXXONMOBIL CHEMICAL PATENTS INC. 2015-04-23 US claimed
US-9771466-B2 Glycol ether-based cyclohexanoate ester plasticizers and blends therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-09-26 US disclosed
US-9228147-B2 Glycol ether-based cyclohexanoate esters, their synthesis and methods of use EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2016-01-05 US disclosed
US-20150112008-A1 Glycol Ether-Based Cyclohexanoate Ester Plasticizers and Blends Therefrom EXXONMOBIL CHEMICAL PATENTS INC. 2015-04-23 US disclosed
WO-2012082826-A1 GLYCOL ETHER-BASED CYCLOHEXANOATE ESTERS, THEIR SYNTHESIS AND METHODS OF USE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2012-06-21 WO disclosed
US-20120149620-A1 GLYCOL ETHER-BASED CYCLOHEXANOATE ESTERS, THEIR SYNTHESIS AND METHODS OF USE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2012-06-14 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-20120149620-A1 GLYCOL ETHER-BASED CYCLOHEXANOATE ESTERS, THEIR SYNTHESIS AND METHODS OF USE GNE, UGT8, GK PPM1B 4666/4885PTPN1 4462/4885PPP1CC 1560/4885

“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.