SCHEMBL10082058

SCHEMBL10082058

O=C(O)C1CNCC(O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.55
FUCA1 P04066 4/20 0.55
GLA P06280 2/20 0.55
GAA P10253 1/20 0.55
GLB1 P16278 1/20 0.55
MAN1B1 Q9UKM7 1/20 0.46
PYGL P06737 1/20 0.41
GBA2 Q9HCG7 1/20 0.41

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
SCHEMBL12334740 1.00 GBA1 (0.55) GBA1FUCA1GLAGAAGLB1
SCHEMBL403895 1.00 GBA1 (0.55) GBA1FUCA1GLAGAAGLB1
SCHEMBL26268116 1.00 GBA1 (0.55) GBA1FUCA1GLAGAAGLB1
SCHEMBL10179391 0.85
SCHEMBL3196556 0.85
SCHEMBL4445650 0.79 GABRR1 (0.43)
SCHEMBL22160590 0.79 GABRR1 (0.43)
SCHEMBL13221050 0.79 GABRR1 (0.43)
SCHEMBL6335676 0.79 GABRR1 (0.43)
SCHEMBL2811192 0.79 GABRR1 (0.43)

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-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF SANOFI-AVENTIS (FR) 2012-03-15 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-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF HPSE, HAAO, HEXD GBA1 135/4885FUCA1 42/4885GLA 167/4885

“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.