⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18899521 | 0.79 | — | — | |
| SCHEMBL13815452 | 0.78 | ALDH1A1 (0.31) | — | |
| SCHEMBL16684625 | 0.77 | — | — | |
| SCHEMBL21241551 | 0.75 | — | — | |
| SCHEMBL13887664 | 0.75 | — | — | |
| SCHEMBL13952255 | 0.70 | — | — | |
| SCHEMBL14445080 | 0.68 | — | — | |
| SCHEMBL22485379 | 0.67 | — | — | |
| SCHEMBL10129382 | 0.65 | — | — | |
| SCHEMBL13509237 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024148149-A2 | COMPOSITIONS AND METHODS FOR CONTROLLING GLUCOSE LEVELS | SIRTSEI PHARMACEUTICALS, INC. (US) | 2024-07-11 | — | — | WO | disclosed |
| WO-2024059705-A1 | COMPOSITIONS AND METHODS FOR TREATING DEPRESSION IN FEMALES | SIRTSEI PHARMACEUTICALS, INC. (US) | 2024-03-21 | — | — | WO | disclosed |
| US-20220119367-A1 | HETEROCYCLIC COMPOUNDS AS ADENOSINE ANTAGONISTS | INTEGRAL BIOSCIENCES PVT. LTD. (IN) | 2022-04-21 | — | — | US | disclosed |