⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12173787 | 0.75 | TRPV1 (0.30) | — | |
| SCHEMBL11400690 | 0.74 | — | — | |
| SCHEMBL4310978 | 0.74 | — | — | |
| SCHEMBL4310976 | 0.74 | — | — | |
| SCHEMBL1781220 | 0.72 | — | — | |
| SCHEMBL1781219 | 0.72 | — | — | |
| SCHEMBL484017 | 0.72 | — | — | |
| SCHEMBL31189055 | 0.70 | ALDH1A1 (0.41) | — | |
| SCHEMBL9331263 | 0.69 | GABRR1 (0.37) | — | |
| SCHEMBL10394425 | 0.69 | GABRR1 (0.37) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1146050-B1 | 4-Substituted-3,6-anhydro-galactose derivatives and their pharmaceutical use | TAKARA BIO INC (JP) | 2009-12-09 | — | — | EP | disclosed |
| EP-1086952-B1 | Anti aptotosis AGENTS | TAKARA BIO INC (JP) | 2007-08-15 | — | — | EP | disclosed |
| US-6608032-B1 | Composition containing specified 3,6-anhydrogalactopyranose; antidiabetic, antirheumatic, antiinflammatory, anticancer agent, inhibits alpha-glycosidase, endotoxin shock, production of tumor necrosis factor, interleukin or prostaglandin | TAKARA SHUZO CO., LTD. (JP) | 2003-08-19 | — | — | US | disclosed |
| EP-1166786-A1 | MEDICINAL COMPOSITIONS | Takara Shuzo Co, Ltd. (JP) | 2002-01-02 | — | — | EP | disclosed |
| EP-1146050-A9 | REMEDIES | Takara Shuzo Co, Ltd. (JP) | 2001-12-05 | — | — | EP | disclosed |
| EP-1146050-A1 | REMEDIES | Takara Shuzo Co, Ltd. (JP) | 2001-10-17 | — | — | EP | disclosed |