⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27867560 | 1.00 | — | — | |
| SCHEMBL48367 | 0.75 | — | — | |
| SCHEMBL321868 | 0.73 | — | — | |
| SCHEMBL13976324 | 0.73 | — | — | |
| SCHEMBL121281 | 0.73 | — | — | |
| SCHEMBL12801948 | 0.73 | — | — | |
| SCHEMBL8776235 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL18270772 | 0.71 | — | — | |
| SCHEMBL21856847 | 0.69 | — | — | |
| SCHEMBL22161352 | 0.69 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7550608-B2 | Processes for the preparation of docetaxel | FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) | 2009-06-23 | — | — | US | disclosed |