SCHEMBL2411023

SCHEMBL2411023

O[C@@H]1[C@@H](O)[C@@H](Oc2cc(-c3ccnc(F)c3)ccc2Cl)SC[C@H]1O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.38
GBA1 P04062 1/20 0.36
UGCG Q16739 1/20 0.36
GBA2 Q9HCG7 1/20 0.36
ADORA2B P29275 2/20 0.32
KMO O15229 2/20 0.32
AAK1 Q2M2I8 3/20 0.32
SCD O00767 1/20 0.32
ADORA2A P29274 1/20 0.31
PDE2A O00408 2/20 0.30
PDE10A Q9Y233 1/20 0.30
MAPK13 O15264 1/20 0.30
MAPK12 P53778 1/20 0.30
MAPK11 Q15759 1/20 0.30
MAPK14 Q16539 1/20 0.30
ADORA3 P0DMS8 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
SCHEMBL2411021 1.00 DYRK1A (0.38) DYRK1AGBA1UGCGGBA2ADORA2B
SCHEMBL2410535 0.88 CYP11B2 (0.39) DYRK1AGBA1UGCGGBA2KMO
SCHEMBL2410541 0.88 CYP11B2 (0.39) DYRK1AGBA1UGCGGBA2KMO
SCHEMBL2410548 0.87 DYRK1A (0.41) DYRK1AKMOAAK1
SCHEMBL2410556 0.87 DYRK1A (0.41) DYRK1AKMOAAK1
SCHEMBL2413268 0.86 DYRK1A (0.36) DYRK1AKMOADORA3
SCHEMBL2413272 0.86 DYRK1A (0.36) DYRK1AKMOADORA3
SCHEMBL315119 0.85 GBA1 (0.34) GBA1UGCGGBA2AAK1
SCHEMBL315120 0.85 GBA1 (0.34) GBA1UGCGGBA2AAK1
SCHEMBL2418141 0.84 GBA1 (0.36) GBA1UGCGGBA2AAK1PDE2A

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-8013010-B2 5-thioxylopyranose compounds LABORATOIRES FOURNIER S.A. (FR) 2011-09-06 US disclosed
US-20090186840-A1 5-Thioxylopyranose Compounds LABORATOIRES FOURNIER S.A (FR) 2009-07-23 US disclosed
EP-2066681-A1 NEW DERIVATIVES OF 5-THIOXILOPYRANOSE LABORATOIRES FOURNIER SA (FR) 2009-06-10 EP disclosed
WO-2008037923-A1 NEW DERIVATIVES OF 5-THIOXILOPYRANOSE LABORATOIRES FOURNIER S.A. (FR) 2008-04-03 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-20090186840-A1 5-Thioxylopyranose Compounds TPMT, PNPO, CYP3A5 DYRK1A 4436/4885GBA1 3030/4885UGCG 1119/4885

“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.