⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2411455 | 1.00 | — | — | |
| SCHEMBL2410710 | 0.86 | PTPN2 (0.33) | — | |
| SCHEMBL2415119 | 0.86 | PTPN2 (0.33) | — | |
| SCHEMBL2415123 | 0.86 | PTPN2 (0.33) | — | |
| SCHEMBL2410712 | 0.86 | PTPN2 (0.33) | — | |
| SCHEMBL314935 | 0.82 | OPRK1 (0.32) | — | |
| SCHEMBL314936 | 0.82 | OPRK1 (0.32) | — | |
| SCHEMBL2409828 | 0.82 | ERN1 (0.32) | — | |
| SCHEMBL2409821 | 0.82 | ERN1 (0.32) | — | |
| SCHEMBL2410451 | 0.81 | ABCB1 (0.31) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |