SCHEMBL13060033

SCHEMBL13060033

CC1CC(C)(C)N(O)C(C)(C)C1N

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL19184734 0.79 GAA (0.54) GAAL3MBTL1
SCHEMBL377190 0.76 GAA (0.56) GAAL3MBTL1
SCHEMBL18545708 0.76 GAA (0.56) GAAL3MBTL1
SCHEMBL11452305 0.74
SCHEMBL7636857 0.73 GAA (0.58) GAAL3MBTL1
SCHEMBL18545631 0.73 GAA (0.58) GAAL3MBTL1
SCHEMBL7506838 0.72 GAA (0.42) GAAL3MBTL1
SCHEMBL143973 0.70 GAA (0.48) GAAL3MBTL1
SCHEMBL27513075 0.69 GAA (0.31) GAAL3MBTL1
Hydrochloric Acid SCHEMBL5044550 0.69 GAA (0.46) GAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100310471-A1 ANTIOXIDANT AND PARAMAGNETIC HEPARIN-NITROXIDE DERIVATIVES Johannes Gutenberg-Universität Mainz (DE) 2010-12-09 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 (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-20100310471-A1 ANTIOXIDANT AND PARAMAGNETIC HEPARIN-NITROXIDE DERIVATIVES PRDX3, PRDX5, PRDX1 GAA 580/4885L3MBTL1 3110/4885

“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.