SCHEMBL5560191

SCHEMBL5560191

CCOC(=O)OC1=C(C)NC(C)=C(OC(=O)OCC)C1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.56
LMNA P02545 5/20 0.56
ALDH1A1 P00352 7/20 0.44
GAA P10253 3/20 0.44
POLB P06746 1/20 0.44
HSD17B10 Q99714 3/20 0.43
TSHR P16473 2/20 0.43
HPGD P15428 2/20 0.43
TP53 P04637 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
KMT2A Q03164 1/20 0.43
SOAT1 P35610 1/20 0.41
HTT P42858 2/20 0.41
MTOR P42345 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
USP2 O75604 1/20 0.38
ABCC1 P33527 1/20 0.37

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
SCHEMBL9690795 0.88 KDM4E (0.45) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL9691786 0.84 KDM4E (0.41) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL7322941 0.75 ADORA3 (0.58) KDM4ELMNAALDH1A1GAAHSD17B10
SCHEMBL9369030 0.73 CACNA1F (0.49) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL3503405 0.72 KDM4E (1.00) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL11336599 0.72 ADORA3 (0.42) KDM4ELMNAALDH1A1HSD17B10HPGD
SCHEMBL9690862 0.71 ALDH1A1 (0.54) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL8106730 0.67 KDM4E (0.86) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL9831380 0.67 KDM4E (0.86) KDM4ELMNAALDH1A1GAAPOLB
SCHEMBL8890327 0.67 KDM4E (0.86) KDM4ELMNAALDH1A1GAAPOLB

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-20070225255-A1 Use of Mitochondrially Targeted Antioxidant in the Treatment of Liver Diseases and Epithelial Cancers ORIDIS BIOMED FORSCHUNGS-UND ENTWICKLUNGS GMBH (AT) 2007-09-27 US disclosed
EP-1765413-A2 MITOCHONDRIALLY TARGETED ANTIOXIDANTS IN THE TREATMENT OF LIVER DISEASES AND EPITHELIAL CANCERS Oridis Biomed Forschungs- und Entwicklungs GmbH (AT) 2007-03-28 EP disclosed
WO-2006005759-A2 MITOCHONDRIALLY TARGETED ANTIOXIDANTS IN THE TREATMENT OF LIVER DISEASES AND EPITHELIAL CANCERS ORIDIS BIOMED FORSCHUNGS- UND ENTWICKLUNGS GMBH (AT) 2006-01-19 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 (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-20070225255-A1 Use of Mitochondrially Targeted Antioxidant in the Treatment of Liver Diseases and Epithelial Cancers GLS2, PRDX5, GSR KDM4E 1850/4885LMNA 2943/4885ALDH1A1 554/4885

“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.