⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2273483 | 0.83 | — | — | |
| SCHEMBL29160379 | 0.69 | — | — | |
| SCHEMBL42436 | 0.64 | — | — | |
| Trichloroethane SCHEMBL8594619 | 0.58 | TSHR (0.55) | — | |
| Methylene Chloride SCHEMBL5375622 | 0.57 | — | — | |
| SCHEMBL1324976 | 0.56 | — | — | |
| SCHEMBL707894 | 0.56 | — | — | |
| Trichloroethane SCHEMBL551406 | 0.56 | — | — | |
| SCHEMBL172298 | 0.56 | — | — | |
| Ethane SCHEMBL11666836 | 0.53 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019242691-A1 | PACLITAXEL-LIPID-POLYSACCHARIDE DUAL-TYPE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF | 圣多利康制药责任有限公司 | 2019-12-26 | — | — | WO | disclosed |