SCHEMBL6575848

SCHEMBL6575848

O=C(OCc1ccccc1)[C@@H](O)[C@H](O)C(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
TDP1 Q9NUW8 3/20 0.59
MAPK1 P28482 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
SLC6A2 P23975 1/20 0.59
SLC6A3 Q01959 1/20 0.59
KMT2A Q03164 1/20 0.59
LTA4H P09960 1/20 0.58
LAP3 P28838 1/20 0.58
LMNA P02545 3/20 0.53
HCAR2 Q8TDS4 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
CTRB1 P17538 2/20 0.47
CDC25B P30305 1/20 0.47

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
SCHEMBL1600361 1.00 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL14066236 1.00 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL366832 1.00 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL6012976 0.94 ALDH1A1 (0.55) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL8426058 0.94 ALDH1A1 (0.55) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
Benzyl Alcohol SCHEMBL27898646 0.92 ALDH1A1 (0.53) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL8424336 0.91 ALDH1A1 (0.56) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL8424338 0.91 ALDH1A1 (0.56) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL15449774 0.91 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL19853604 0.91 ALDH1A1 (0.52) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114082312-B Hollow fiber membrane with chiral selectivity and method for separating metoprolol enantiomer by using same 广州白云山汉方现代药业有限公司 2024-02-20 CN claimed
CN-114082312-A Hollow fiber membrane with chiral selectivity and method for separating metoprolol enantiomer by using same 广州白云山汉方现代药业有限公司 2022-02-25 CN claimed
CN-118879801-A Left Carniy Synthesis process of statin 山东玉满坤生物科技有限公司 2024-11-01 CN disclosed
CN-114082312-B Hollow fiber membrane with chiral selectivity and method for separating metoprolol enantiomer by using same 广州白云山汉方现代药业有限公司 2024-02-20 CN disclosed
CN-114621126-B Improved ezetimibe preparation method 重庆圣华曦药业股份有限公司 2023-07-25 CN disclosed
CN-114621126-A Improved preparation method of ezetimibe 重庆圣华曦药业股份有限公司 2022-06-14 CN disclosed
CN-114082312-A Hollow fiber membrane with chiral selectivity and method for separating metoprolol enantiomer by using same 广州白云山汉方现代药业有限公司 2022-02-25 CN disclosed
EP-2861558-B1 MACROMOLECULES FOR TREATING ATHEROSCLEROSIS UNIV RUTGERS (US) 2017-01-18 EP disclosed
US-9434681-B2 Macromolecules for treating atherosclerosis RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-09-06 US disclosed
US-9434681-B2 Macromolecules for treating atherosclerosis RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-09-06 US disclosed
US-20150175528-A1 MACROMOLECULES FOR TREATING ATHEROSCLEROSIS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2015-06-25 US disclosed
US-20150175528-A1 MACROMOLECULES FOR TREATING ATHEROSCLEROSIS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2015-06-25 US disclosed
WO-2013188882-A1 MACROMOLECULES FOR TREATING ATHEROSCLEROSIS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-12-19 WO disclosed
JP-2004300070-A ACETAL ADDUCT OF MUSCONE, METHOD FOR PREPARING THE ADDUCT, AND METHOD FOR OPTICAL RESOLUTION OF (±)-MUSCONE KAWAGUCHI YAKUHIN KK 2004-10-28 JP 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-20150175528-A1 MACROMOLECULES FOR TREATING ATHEROSCLEROSIS APOB, MSR1, APOL1 ALDH1A1 3245/4885TDP1 2465/4885MAPK1 3471/4885

“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.