⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23701074 | 0.73 | — | — | |
| SCHEMBL436453 | 0.70 | — | — | |
| SCHEMBL11418906 | 0.67 | — | — | |
| SCHEMBL37444 | 0.67 | — | — | |
| SCHEMBL15449794 | 0.67 | — | — | |
| SCHEMBL2394589 | 0.67 | — | — | |
| SCHEMBL2884900 | 0.67 | — | — | |
| SCHEMBL1417 | 0.67 | — | — | |
| Bromide SCHEMBL20500209 | 0.67 | — | — | |
| SCHEMBL566362 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2697211-A1 | PROCESS FOR PREPARING DOCETAXEL AND ITS HYDRATE | Shilpa Medicare Limited (IN) | 2014-02-19 | — | — | EP | disclosed |
| WO-2012131698-A1 | PROCESS FOR PREPARING DOCETAXEL AND ITS HYDRATE | SHILPA MEDICARE LIMITED (IN) | 2012-10-04 | — | — | WO | disclosed |