SCHEMBL18154635

SCHEMBL18154635

COC(=O)[O-].COC(=O)[O-].[Ba+2]

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
CA1 P00915 2/20 0.43
NPSR1 Q6W5P4 1/20 0.40
TSHR P16473 3/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
CA4 P22748 5/20 0.38
HSD17B10 Q99714 1/20 0.35
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
FAHD1 Q6P587 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
SCHEMBL7519688 0.96
SCHEMBL7627644 0.92 ALDH1A1 (0.47) ALDH1A1CA1NPSR1TSHRKEAP1
SCHEMBL7042120 0.92
SCHEMBL10490552 0.92 ALDH1A1 (0.47) ALDH1A1CA1NPSR1TSHRKEAP1
Potassium Ion SCHEMBL1007640 0.92
SCHEMBL1681011 0.92 ALDH1A1 (0.47) ALDH1A1CA1NPSR1TSHRKEAP1
Potassium Ion SCHEMBL11850339 0.92 CA4 (0.47) ALDH1A1CA1NPSR1TSHRKEAP1
Lithium Ion SCHEMBL6352034 0.92
SCHEMBL4754719 0.92
SCHEMBL7045610 0.92

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107466289-B Process for producing ethylenically unsaturated carboxylic acids or esters 三菱化学英国有限公司 2021-09-17 CN claimed
EP-3283456-B1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS MITSUBISHI CHEMICAL UK LTD (GB) 2021-06-23 EP claimed
US-10464875-B2 Process for the production of ethylenically unsaturated carboxylic acids or esters LUCITE INTERNATIONAL UK LIMITED (GB) 2019-11-05 US claimed
US-20180093937-A1 PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS Mitsubishi Chemical UK Limited (GB) 2018-04-05 US claimed
EP-3283456-A1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS Lucite International UK Limited (GB) 2018-02-21 EP claimed
WO-2016166525-A1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS LUCITE INTERNATIONAL UK LIMITED (GB) 2016-10-20 WO claimed
EP-3526191-B1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACID ESTERS AND A CATALYST THEREFOR MITSUBISHI CHEMICAL UK LTD (GB) 2024-05-22 EP disclosed
CN-110382454-B Process for producing ethylenically unsaturated carboxylic acid esters and catalyst therefor 三菱化学英国有限公司 2023-05-30 CN disclosed
EP-3283456-B1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS MITSUBISHI CHEMICAL UK LTD (GB) 2021-06-23 EP disclosed
US-10683255-B2 Process for the production of ethylenically unsaturated carboxylic acid esters and a catalyst therefor LUCITE INTERNATIONAL UK LIMITED (GB) 2020-06-16 US disclosed
US-10464875-B2 Process for the production of ethylenically unsaturated carboxylic acids or esters LUCITE INTERNATIONAL UK LIMITED (GB) 2019-11-05 US disclosed
EP-3526191-A1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACID ESTERS AND A CATALYST THEREFOR Lucite International UK Limited (GB) 2019-08-21 EP disclosed
WO-2018069702-A1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACID ESTERS AND A CATALYST THEREFOR LUCITE INTERNATIONAL UK LIMITED (GB) 2018-04-19 WO disclosed
US-20180093937-A1 PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS Mitsubishi Chemical UK Limited (GB) 2018-04-05 US disclosed
EP-3283456-A1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS Lucite International UK Limited (GB) 2018-02-21 EP disclosed
WO-2016166525-A1 A PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS LUCITE INTERNATIONAL UK LIMITED (GB) 2016-10-20 WO 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 (3 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-10464875-B2 Process for the production of ethylenically unsaturated carboxylic acids or esters ELOVL1, ELOVL5, FASN ALDH1A1 273/4885CA1 146/4885NPSR1 3409/4885
US-10683255-B2 Process for the production of ethylenically unsaturated carboxylic acid esters and a catalyst therefor MCCC2, FAR1, HADHB ALDH1A1 1006/4885CA1 99/4885NPSR1 3914/4885
US-20180093937-A1 PROCESS FOR THE PRODUCTION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS OR ESTERS ELOVL1, ELOVL5, FASN ALDH1A1 276/4885CA1 160/4885NPSR1 3383/4885

“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.