SCHEMBL8780916

SCHEMBL8780916

CCOC(=O)CC(=O)CCC(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.58
MGAM O43451 1/20 0.58
SI P14410 1/20 0.58
MGAM2 Q2M2H8 1/20 0.58
TSHR P16473 3/20 0.56
LMNA P02545 2/20 0.52
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 4/20 0.43
TRPA1 O75762 1/20 0.43
CYP1A2 P05177 2/20 0.42
KMT2A Q03164 3/20 0.41
HTT P42858 2/20 0.41
MAPT P10636 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CA12 O43570 1/20 0.38
CA14 Q9ULX7 1/20 0.38

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
SCHEMBL28759966 0.91 GAA (0.52) GAAMGAMSIMGAM2TSHR
SCHEMBL1224654 0.91 GAA (0.64) GAAMGAMSIMGAM2TSHR
Malonic Acid Diethyl Ester SCHEMBL28747435 0.89 GAA (0.75) GAAMGAMSIMGAM2TSHR
SCHEMBL7920381 0.88 TSHR (0.54) GAAMGAMSIMGAM2TSHR
SCHEMBL1981808 0.86 TSHR (0.68) GAAMGAMSIMGAM2TSHR
SCHEMBL19127030 0.86 TSHR (0.52) GAAMGAMSIMGAM2TSHR
SCHEMBL28756040 0.84 GAA (0.67) GAAMGAMSIMGAM2TSHR
SCHEMBL6560703 0.84 TSHR (0.72) GAAMGAMSIMGAM2TSHR
SCHEMBL11246615 0.83 GAA (0.58) GAAMGAMSIMGAM2TSHR
SCHEMBL12561239 0.83 GAA (0.58) GAAMGAMSIMGAM2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9186325-B2 Lipids and compositions for the delivery of therapeutics TEKMIRA PHARMACEUTICALS CORPORATION (CA) 2015-11-17 US disclosed
US-9186325-B2 Lipids and compositions for the delivery of therapeutics TEKMIRA PHARMACEUTICALS CORPORATION (CA) 2015-11-17 US disclosed
US-20110311582-A1 NOVEL LIPIDS AND COMPOSITIONS FOR THE DELIVERY OF THERAPEUTICS ARBUTUS BIOPHARMA CORPORATION (CA) 2011-12-22 US disclosed
US-20110311582-A1 NOVEL LIPIDS AND COMPOSITIONS FOR THE DELIVERY OF THERAPEUTICS ARBUTUS BIOPHARMA CORPORATION (CA) 2011-12-22 US disclosed
US-20090263322-A1 OCTAHYDRO-INDOLIZINE AND QUINOLIZINE AND HEXAHYDRO-PYRROLIZINES APODACA RICHARD 2009-10-22 US disclosed
CN-100486970-C Preparation method of racemic homocitric acid lactone UNIV XIAMEN (CN) 2009-05-13 CN disclosed
CN-100402513-C Preparation method of racemic homocitric acid lactone UNIV XIAMEN (CN) 2008-07-16 CN disclosed
CN-1948299-A Preparation method of racemic homocitric acid lactone XIAMEN UIV (CN) 2007-04-18 CN disclosed
CN-1927853-A Preparation method of racemic homocitric acid lactone UNIV XIAMEN (CN) 2007-03-14 CN disclosed
EP-0697407-B1 Pyrimidinedione derivatives and antiarrhythmic compositions containing same MITSUI TOATSU CHEMICALS (JP) 1997-06-25 EP disclosed
EP-0697407-A1 Pyrimidinedione derivatives and antiarrhythmic compositions containing same MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-02-21 EP 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 (2 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-20110311582-A1 NOVEL LIPIDS AND COMPOSITIONS FOR THE DELIVERY OF THERAPEUTICS APOB, LPAR3, LPAR2 GAA 3050/4885MGAM 3528/4885SI 1380/4885
US-20090263322-A1 OCTAHYDRO-INDOLIZINE AND QUINOLIZINE AND HEXAHYDRO-PYRROLIZINES HRH4, HNMT, HRH1 GAA 1555/4885MGAM 2565/4885SI 466/4885

“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.