SCHEMBL13772540

SCHEMBL13772540

CO[C@@H]1OC(CO)[C@@H](O)C(N=[N+]=[N-])C1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 7/20 0.43
▸ ALDH1A1 P00352 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ MGAM O43451 4/20 0.36
▸ SI P14410 4/20 0.36
▸ GAA P10253 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MAPT P10636 1/20 0.34

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
SCHEMBL15267647 1.00 LGALS8 (0.43) LGALS8ALDH1A1HIF1AMGAMSI
SCHEMBL20582504 0.92 LGALS8 (0.41) LGALS8ALDH1A1HIF1AMGAMSI
SCHEMBL15267318 0.88 LGALS8 (0.39) LGALS8ALDH1A1HIF1AMGAMSI
SCHEMBL15267646 0.88 LGALS8 (0.39) LGALS8ALDH1A1HIF1AMGAMSI
SCHEMBL23723836 0.88 LGALS8 (0.43) LGALS8ALDH1A1HIF1AGAAL3MBTL1
SCHEMBL13482776 0.88 LGALS8 (0.43) LGALS8ALDH1A1HIF1AGAAL3MBTL1
SCHEMBL14864297 0.88 LGALS8 (0.43) LGALS8ALDH1A1HIF1AGAAL3MBTL1
SCHEMBL18723048 0.88 LGALS8 (0.43) LGALS8ALDH1A1HIF1AGAAL3MBTL1
SCHEMBL20033536 0.88 LGALS8 (0.43) LGALS8ALDH1A1HIF1AGAAL3MBTL1
SCHEMBL16504207 0.88 LGALS8 (0.43) LGALS8ALDH1A1HIF1AGAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2036917-B1 NOVEL AMINOGLYCOSIDE ANTIBIOTIC MEIJI SEIKA PHARMA CO LTD (JP) 2015-10-07 — — EP disclosed
US-20120165283-A1 NOVEL AMINOGLYCOSIDE ANTIBIOTICS KOBAYASHI YOSHIHIKO (JP) 2012-06-28 — — US disclosed
US-8148504-B2 Aminoglycoside antibiotics MEIJI SEIKA PHARMA CO., LTD. (JP) 2012-04-03 — — US disclosed
US-20090186841-A1 Novel aminoglycoside antibiotics MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-07-23 — — 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 (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-20120165283-A1 NOVEL AMINOGLYCOSIDE ANTIBIOTICS ATP6V1B1, REN, NRDC LGALS8 1932/4885ALDH1A1 819/4885HIF1A 407/4885
US-20090186841-A1 Novel aminoglycoside antibiotics ATP6V1B1, REN, NRDC LGALS8 1932/4885ALDH1A1 819/4885HIF1A 407/4885

“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.

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