⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL277046 | 0.78 | TSHR (0.31) | — | |
| SCHEMBL4908226 | 0.77 | MAPT (0.33) | — | |
| SCHEMBL1705520 | 0.76 | — | — | |
| SCHEMBL3034318 | 0.74 | — | — | |
| SCHEMBL3035605 | 0.73 | — | — | |
| SCHEMBL3040930 | 0.71 | — | — | |
| SCHEMBL1532776 | 0.67 | — | — | |
| SCHEMBL10384145 | 0.67 | — | — | |
| SCHEMBL7498687 | 0.67 | — | — | |
| SCHEMBL575138 | 0.67 | LMNA (0.35) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1856080-B1 | METHOD FOR PREPARING DOCETAXEL | SERIPHARM (FR) | 2010-12-01 | — | — | EP | claimed |
| US-20080200699-A1 | Deacylation of paclitaxel ; blocking using blocking agent; debenzoylation the amine; reacting with peroxy compound; condensation | SERIPHARM (FR) | 2008-08-21 | — | — | US | claimed |
| US-20080200699-A1 | Deacylation of paclitaxel ; blocking using blocking agent; debenzoylation the amine; reacting with peroxy compound; condensation | SERIPHARM (FR) | 2008-08-21 | — | — | US | disclosed |