⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9301155 | 0.97 | CES2 (0.31) | — | |
| SCHEMBL9299073 | 0.83 | — | — | |
| Trimethylammonium SCHEMBL9299889 | 0.82 | — | — | |
| SCHEMBL9300340 | 0.81 | — | — | |
| SCHEMBL7040826 | 0.79 | — | — | |
| SCHEMBL3185415 | 0.79 | — | — | |
| SCHEMBL7038262 | 0.79 | — | — | |
| SCHEMBL21979551 | 0.79 | — | — | |
| SCHEMBL7037712 | 0.72 | — | — | |
| SCHEMBL28383252 | 0.72 | — | — |
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-5360573-A | Acetylated sugars as activators | LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) | 1994-11-01 | — | — | US | claimed |