SCHEMBL315085

SCHEMBL315085

Cc1cc(-c2cncc(O[C@H]3SC[C@@H](O)[C@H](O)[C@H]3O)c2)ccn1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.37
DYRK1A Q13627 1/20 0.36
PIK3CB P42338 1/20 0.36
PORCN Q9H237 4/20 0.35
ABL1 P00519 1/20 0.34
AAK1 Q2M2I8 4/20 0.32
WNT3A P56704 4/20 0.32
PDK2 Q15119 1/20 0.32
PIK3C3 Q8NEB9 1/20 0.31

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
SCHEMBL315084 1.00 CYP11B2 (0.37) CYP11B2DYRK1APIK3CBPORCNABL1
SCHEMBL316440 0.87 MAPT (0.34) DYRK1AAAK1
SCHEMBL315299 0.87 CYP19A1 (0.33) AAK1PIK3C3
SCHEMBL315298 0.87 CYP19A1 (0.33) AAK1PIK3C3
SCHEMBL316441 0.87 MAPT (0.34) DYRK1AAAK1
SCHEMBL2408847 0.86 WNT3A (0.38) DYRK1APIK3CBPORCNABL1WNT3A
SCHEMBL2408850 0.86 WNT3A (0.38) DYRK1APIK3CBPORCNABL1WNT3A
SCHEMBL315429 0.86 ADORA3 (0.32) CYP11B2
SCHEMBL315430 0.86 ADORA3 (0.32) CYP11B2
SCHEMBL2139781 0.84 CYP11B1 (0.34) CYP11B2DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093394-B2 Derivatives of 5-thioxylopyranose and use of same for treatment LABORATOIRES FOURNIER S.A. (FR) 2012-01-10 US disclosed
EP-2066683-B1 DERIVATIVES OF 5-THIOXYLOPYRANOSE AND USE OF SAME FOR TREATMENT FOURNIER LAB SA (FR) 2010-11-03 EP disclosed
US-20090182013-A1 Derivatives of 5-Thioxylopyranose and Use of Same for Treatment LABORATOIRES FOURNIER S.A. (FR) 2009-07-16 US disclosed
EP-2066683-A1 DERIVATIVES OF 5-THIOXYLOPYRANOSE AND USE OF SAME FOR TREATMENT LABORATOIRES FOURNIER SA (FR) 2009-06-10 EP disclosed
WO-2008037922-A1 DERIVATIVES OF 5-THIOXYLOPYRANOSE AND USE OF SAME FOR TREATMENT 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-20090182013-A1 Derivatives of 5-Thioxylopyranose and Use of Same for Treatment TPMT, PNPO, PPOX CYP11B2 261/4885DYRK1A 3070/4885PIK3CB 1936/4885

“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.