SCHEMBL2410075

SCHEMBL2410075

O[C@@H]1[C@@H](O)[C@@H](Oc2ccc(-c3ccoc3)cc2)SC[C@H]1O

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
PTPN11 Q06124 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
EP300 Q09472 2/20 0.31
LTA4H P09960 1/20 0.31
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
P2RX3 P56373 1/20 0.30
KDM1A O60341 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
KDM1B Q8NB78 1/20 0.30
RCOR1 Q9UKL0 1/20 0.30
ERN1 O75460 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
SCHEMBL2410073 1.00 PPARD (0.33) PPARDPPARAPTPN1PTPN6PTPN11
SCHEMBL2417674 0.84 SERPINE1 (0.34) ERN1
SCHEMBL2417675 0.84 SERPINE1 (0.34) ERN1
SCHEMBL316426 0.82 FYN (0.34) PTPN1PTPN6PTPN11ADORA3
SCHEMBL316425 0.82 FYN (0.34) PTPN1PTPN6PTPN11ADORA3
SCHEMBL315864 0.82 ALPL (0.33) ADORA3
SCHEMBL315863 0.82 ALPL (0.33) ADORA3
SCHEMBL2416638 0.80 CYP3A4 (0.34) ADORA3
SCHEMBL2416640 0.80 CYP3A4 (0.34) ADORA3
SCHEMBL2416182 0.80 ERN1 (0.34) ERN1

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 PPARD 2671/4885PPARA 2293/4885PTPN1 379/4885

“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.