SCHEMBL13295366

SCHEMBL13295366

CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(C)OC(C)=O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.79
ABCB1 P08183 1/20 0.43
POLB P06746 1/20 0.42
MAPK1 P28482 1/20 0.42
TSHR P16473 2/20 0.37
TRPV1 Q8NER1 1/20 0.35
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
GALR3 O60755 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALOX15 P16050 1/20 0.32
PGD P52209 1/20 0.31
GAA P10253 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
SCHEMBL7149904 1.00 TDP1 (0.79) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL7153751 1.00 TDP1 (0.79) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL7154920 1.00 TDP1 (0.79) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL23720379 0.98 TDP1 (0.82) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL21544876 0.91 TDP1 (0.71) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL27754500 0.91 TDP1 (0.66) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL826717 0.90 TDP1 (0.96) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL2175855 0.90 TDP1 (0.96) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL270042 0.90 TDP1 (0.96) TDP1ABCB1POLBMAPK1TSHR
SCHEMBL7149374 0.90 TDP1 (0.96) TDP1ABCB1POLBMAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11591416-B2 Exopolysaccharides and uses thereof SOFAR S.P.A. (IT) 2023-02-28 US claimed
US-20190345268-A1 EXOPOLYSACCHARIDES AND USES THEREOF ALFASIGMA S.P.A. (IT) 2019-11-14 US claimed
US-11591416-B2 Exopolysaccharides and uses thereof SOFAR S.P.A. (IT) 2023-02-28 US disclosed
US-11407768-B2 AMPK activators KALLYOPE, INC. (US) 2022-08-09 US disclosed
EP-3978488-A1 ZINC CHELATING COMPOUNDS FOR USE IN THE TREATMENT OF BACTERIAL INFECTION Universitetet I Oslo (NO) 2022-04-06 EP disclosed
US-20190345268-A1 EXOPOLYSACCHARIDES AND USES THEREOF ALFASIGMA S.P.A. (IT) 2019-11-14 US disclosed
US-8540966-B2 Contrast agents endowed with high relaxivity BRACCO IMAGING S.P.A. (IT) 2013-09-24 US disclosed
US-20110256067-A1 Contrast agents endowed with high relaxivity BRACCO IMAGING SPA (IT) 2011-10-20 US disclosed
US-7732625-B2 Colorant compounds XEROX CORPORATION (US) 2010-06-08 US disclosed
US-7311767-B2 Forming a salt of a liquid phase change ink carrier of stearyl stearamide, an amine substituted Xanthene, acridine, anthracene or thioxanthene chromogen, and a metal salt capable of forming a compound with two chromogens XEROX CORPORATION (US) 2007-12-25 US disclosed
US-7301025-B2 N-(2-(2-(alkyl[carbamoyl, carbonyloxy or ureido]alkyl)pyridinium)-5-(carboxy or sulfo)phenyl-8-((2-(N-alkyl[carbamoyl or ureido]alkyl)pyridinyl) xanthene ligands complexed with a metal or metal-containing moiety; magenta dye with improved heat resistance; hot melts or phase change inks XEROX CORPORATION (US) 2007-11-27 US disclosed
US-7176317-B2 Colorant compounds XEROX CORPORATION (US) 2007-02-13 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 (4 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-20110256067-A1 Contrast agents endowed with high relaxivity SLC40A1, SLC67A1, SLC19A1 TDP1 1664/4885ABCB1 1017/4885POLB 2289/4885
US-11591416-B2 Exopolysaccharides and uses thereof TLR5, TLR3, TLR2 TDP1 3938/4885ABCB1 4419/4885POLB 4212/4885
US-11407768-B2 AMPK activators PRKAG1, PRKAG2, PRKAA1 TDP1 3084/4885ABCB1 4425/4885POLB 3399/4885
US-20190345268-A1 EXOPOLYSACCHARIDES AND USES THEREOF TLR5, TLR3, TLR2 TDP1 3938/4885ABCB1 4419/4885POLB 4212/4885

“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.