SCHEMBL439043

SCHEMBL439043

O=C(O)N1CC(CO)C(O)C(OCc2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 4/20 0.44
PYGL P06737 1/20 0.40
CTSL P07711 2/20 0.39
CTSB P07858 2/20 0.39
CTSK P43235 2/20 0.39
CTSV O60911 1/20 0.39
CTSS P25774 1/20 0.39
CTSC P53634 1/20 0.39
CTSF Q9UBX1 1/20 0.39
PDE4D Q08499 1/20 0.39
GAA P10253 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
BCHE P06276 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL5447024 0.89 SMN1; SMN2 (0.48) GBA1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL441959 0.87 BCHE (0.42) CTSLCTSBCTSKCTSVCTSS
SCHEMBL2456870 0.83 SMN1; SMN2 (0.40) CTSLCTSBCTSKCTSVCTSS
SCHEMBL18040923 0.82 BCHE (0.43) CTSLCTSBCTSKCTSVCTSS
SCHEMBL8183448 0.82 GBA1 (0.44) GBA1PYGLCTSLCTSBCTSK
SCHEMBL8181514 0.82 GBA1 (0.44) GBA1PYGLCTSLCTSBCTSK
SCHEMBL8187072 0.81 GBA1 (0.47) GBA1PYGLCTSLCTSBCTSK
SCHEMBL403643 0.80 GBA1 (0.66) GBA1PYGL
SCHEMBL440211 0.80 GBA1 (0.66) GBA1PYGL
SCHEMBL2454394 0.80 GBA1 (0.66) GBA1PYGL

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-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF SANOFI-AVENTIS (FR) 2012-03-15 US disclosed
EP-1773854-B1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF SANOFI SA (FR) 2011-09-21 EP disclosed
EP-1773854-A2 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF Sanofi-Aventis (FR) 2007-04-18 EP disclosed
WO-2006021653-A2 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF SANOFI-AVENTIS (FR) 2006-03-02 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 (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 135/4885PYGL 719/4885CTSL 158/4885

“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.