SCHEMBL9276971

SCHEMBL9276971

O=S(=O)(O)OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 5/20 0.53
▸ LGALS8 O00214 1/20 0.46
▸ LGALS3 P17931 1/20 0.46
▸ LGALS4 P56470 1/20 0.46
▸ MAPT P10636 1/20 0.44
▸ AMY1A P0DUB6 1/20 0.44
▸ AMY2A P04746 3/20 0.43
▸ FGF1 P05230 1/20 0.43
▸ CA12 O43570 4/20 0.43
▸ CA1 P00915 4/20 0.43
▸ CA9 Q16790 4/20 0.43
▸ HPSE Q9Y251 2/20 0.42
▸ F10 P00742 1/20 0.42
▸ CA14 Q9ULX7 2/20 0.42
▸ BLM P54132 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL30089439 1.00 CA2 (0.53) CA2LGALS8LGALS3LGALS4MAPT
SCHEMBL29068320 1.00 CA2 (0.53) CA2LGALS8LGALS3LGALS4MAPT
SCHEMBL4761249 1.00 CA2 (0.53) CA2LGALS8LGALS3LGALS4MAPT
Cellobiose SCHEMBL15211052 0.99 CA2 (0.52) CA2LGALS8LGALS3LGALS4MAPT
SCHEMBL30089360 0.95 CA2 (0.50) CA2LGALS8LGALS3LGALS4MAPT
SCHEMBL30089438 0.95 CA2 (0.49) CA2LGALS8LGALS3LGALS4MAPT
SCHEMBL26264978 0.91 CA2 (0.47) CA2LGALS8LGALS3LGALS4MAPT
Cellobiose SCHEMBL4761241 0.88 LGALS8 (0.54) CA2LGALS8LGALS3LGALS4MAPT
Maltose SCHEMBL9704098 0.86 LGALS8 (0.53) CA2LGALS8LGALS3LGALS4MAPT
SCHEMBL25241935 0.85 CA2 (0.47) CA2LGALS3FGF1CA12CA1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2646037-B1 use of polyanions to inhibit the cytotoxic activity of histones in the treatment of sepsis. UNIV AUSTRALIAN NATIONAL (AU) 2019-01-09 — — EP claimed
US-9226939-B2 Histone inhibition THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2016-01-05 — — US claimed
US-20130338097-A1 HISTONE INHIBITION THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2013-12-19 — — US claimed
EP-2646037-A1 HISTONE INHIBITION The Australian National University (AU) 2013-10-09 — — EP claimed
WO-2012071611-A1 HISTONE INHIBITION THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2012-06-07 — — WO claimed
CN-111479574-B Compounds for the treatment and prevention of extracellular histone mediated pathologies 澳大利亚国立大学 2024-02-09 — — CN disclosed
CN-117462563-A Compounds for the treatment and prevention of extracellular histone mediated pathologies 澳大利亚国立大学 2024-01-30 — — CN disclosed
CN-117427084-A Compounds for the treatment and prevention of extracellular histone mediated pathologies 澳大利亚国立大学 2024-01-23 — — CN disclosed
CN-116813675-B Compound crystal form and preparation, composition and application thereof 北京远大九和药业有限公司 2023-11-24 — — CN disclosed
CN-117088925-A Compound crystal form and preparation, composition and application thereof 北京远大九和药业有限公司 2023-11-21 — — CN disclosed
CN-116813675-A Compound crystal form and preparation, composition and application thereof 北京远大九和药业有限公司 2023-09-29 — — CN disclosed
US-20230255992-A1 COMPOUNDS FOR TREATING AND PREVENTING EXTRACELLULAR HISTONE MEDIATED PATHOLOGIES THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2023-08-17 — — US disclosed
EP-3723768-A1 COMPOUNDS FOR TREATING AND PREVENTING EXTRACELLULAR HISTONE MEDIATED PATHOLOGIES The Australian National University (AU) 2020-10-21 — — EP disclosed
CN-111479574-A Compounds for the treatment and prevention of extracellular histone mediated pathologies 澳大利亚国立大学 2020-07-31 — — CN disclosed
WO-2019113645-A1 COMPOUNDS FOR TREATING AND PREVENTING EXTRACELLULAR HISTONE MEDIATED PATHOLOGIES THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2019-06-20 — — WO disclosed
EP-2646037-B1 use of polyanions to inhibit the cytotoxic activity of histones in the treatment of sepsis. UNIV AUSTRALIAN NATIONAL (AU) 2019-01-09 — — EP disclosed
US-9226939-B2 Histone inhibition THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2016-01-05 — — US disclosed
US-20130338097-A1 HISTONE INHIBITION THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2013-12-19 — — US disclosed
EP-2646037-A1 HISTONE INHIBITION The Australian National University (AU) 2013-10-09 — — EP disclosed
WO-2012071611-A1 HISTONE INHIBITION THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2012-06-07 — — 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 (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-20130338097-A1 HISTONE INHIBITION H1-5, H1-3, H1-2 CA2 2445/4885LGALS8 3263/4885LGALS3 3126/4885
US-20230255992-A1 COMPOUNDS FOR TREATING AND PREVENTING EXTRACELLULAR HISTONE MEDIATED PATHOLOGIES HMGB1, HDAC2, H1-3 CA2 1565/4885LGALS8 1839/4885LGALS3 2125/4885

“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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