⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11037905 | 0.71 | — | — | |
| SCHEMBL1301719 | 0.69 | — | — | |
| SCHEMBL682640 | 0.69 | — | — | |
| SCHEMBL19296665 | 0.65 | — | — | |
| SCHEMBL29654958 | 0.63 | ALDH1A1 (0.30) | — | |
| SCHEMBL25401725 | 0.62 | — | — | |
| SCHEMBL9999650 | 0.62 | — | — | |
| SCHEMBL7062360 | 0.62 | — | — | |
| SCHEMBL19296670 | 0.61 | — | — | |
| SCHEMBL3333539 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6555678-B1 | Reacting with a silylating agent, extracting the silylated cellulose from the synthesis reaction medium, spinning through extrusion die(s), and treating the resultant yarn with a desilylation agent to regenerate the celluose and a siloxane | RHODIA ACETOW (DE) | 2003-04-29 | — | — | US | disclosed |
| EP-1025291-B1 | METHOD FOR PREPARING A REGENERATED CELLULOSE FIBRE OR YARN | RHODIA ACETOW (DE) | 2003-04-09 | — | — | EP | disclosed |
| WO-1999021892-A1 | METHOD FOR SILYLATING CARBOHYDRATES | RHODIA ACETOW (DE) | 1999-05-06 | — | — | WO | disclosed |