SCHEMBL404047

SCHEMBL404047

CCSC1OC2COC(C)(C)O[C@H]2[C@@H](OC)C1O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL454715 1.00 CA1 (0.35) CA1CA2CA9L3MBTL1
SCHEMBL14389032 1.00 CA1 (0.35) CA1CA2CA9L3MBTL1
SCHEMBL5460304 0.83 PKM (0.35) CA1CA2CA9
SCHEMBL402647 0.83 PKM (0.35) CA1CA2CA9
SCHEMBL12233109 0.76 CA1 (0.37) CA1CA2CA9
SCHEMBL1648065 0.76 ALDH1A1 (0.37) L3MBTL1
SCHEMBL12729386 0.76 ALDH1A1 (0.37) L3MBTL1
SCHEMBL7150055 0.70 MEN1 (0.40) CA1CA2CA9L3MBTL1
SCHEMBL20141974 0.70 MEN1 (0.40) CA1CA2CA9L3MBTL1
SCHEMBL3318804 0.70 MEN1 (0.40) CA1CA2CA9L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF SANOFI-AVENTIS (FR) 2012-03-15 — — US disclosed
US-20070270354-A1 Azasugar derivatives, heparanase inhibitors, method for preparing same, compositions containing same, use thereof SANOFI-AVENTIS (FR) 2007-11-22 — — 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-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF HPSE, HAAO, HEXD CA1 121/4885CA2 268/4885CA9 36/4885
US-20070270354-A1 Azasugar derivatives, heparanase inhibitors, method for preparing same, compositions containing same, use thereof HPSE, HAAO, HEXD CA1 123/4885CA2 273/4885CA9 36/4885

“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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