SCHEMBL4929037

SCHEMBL4929037

OC[C@H]1O[C@@H](n2cc(-c3nccs3)c3ccccc32)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADK P55263 6/20 0.62
SLC5A2 P31639 5/20 0.52
SLC5A1 P13866 1/20 0.52
MAPT P10636 1/20 0.44
CDA P32320 1/20 0.44

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
SCHEMBL4923936 0.84 ADK (0.55) ADK
SCHEMBL13092037 0.76 ADK (1.00) ADKMAPT
SCHEMBL16968468 0.76 ADK (1.00) ADKMAPT
SCHEMBL16978217 0.76 ADK (1.00) ADKMAPT
SCHEMBL18744585 0.76 ADK (1.00) ADKMAPT
SCHEMBL23147965 0.76 SLC5A2 (0.63) SLC5A2SLC5A1
SCHEMBL22493077 0.76 SLC5A2 (0.63) SLC5A2SLC5A1
SCHEMBL20556173 0.76 SLC5A2 (0.63) SLC5A2SLC5A1
SCHEMBL28939188 0.76 ADK (0.60) ADKMAPTCDA
SCHEMBL13621803 0.75 SLC5A2 (0.71) SLC5A2SLC5A1

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
US-20080139484-A1 1(Beta-D-Glycopyranosyl)-3-Substituted Nitrogenous Heterocyclic Compound, Medicinal Composition Containing the Same, and Medicinal Use Thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-06-12 US claimed
EP-1803729-A1 1-( -D-GLYCOPYRANOSYL)-3-SUBSTITUTED NITROGENOUS HETEROCYCLIC COMPOUND, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2007-07-04 EP claimed
US-20080139484-A1 1(Beta-D-Glycopyranosyl)-3-Substituted Nitrogenous Heterocyclic Compound, Medicinal Composition Containing the Same, and Medicinal Use Thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-06-12 US disclosed
EP-1803729-A1 1-( -D-GLYCOPYRANOSYL)-3-SUBSTITUTED NITROGENOUS HETEROCYCLIC COMPOUND, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2007-07-04 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 (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-20080139484-A1 1(Beta-D-Glycopyranosyl)-3-Substituted Nitrogenous Heterocyclic Compound, Medicinal Composition Containing the Same, and Medicinal Use Thereof SLC5A1, SLC5A2, UGGT1 ADK 2288/4885SLC5A2 2/4885SLC5A1 1/4885

“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.