⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23260159 | 1.00 | — | — | |
| SCHEMBL23260160 | 1.00 | — | — | |
| SCHEMBL5932944 | 0.87 | TAAR1 (0.33) | — | |
| SCHEMBL2030703 | 0.75 | TDP1 (0.41) | — | |
| SCHEMBL331532 | 0.73 | — | — | |
| SCHEMBL12488569 | 0.73 | — | — | |
| SCHEMBL10396547 | 0.73 | — | — | |
| SCHEMBL24477204 | 0.73 | — | — | |
| SCHEMBL24728861 | 0.71 | TDP1 (0.37) | — | |
| SCHEMBL15026792 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230219927-A1 | AKT3 MODULATORS | Georgiamune Inc. | 2023-07-13 | — | — | US | disclosed |
| US-20090297779-A1 | POLYURETHANE FOAM ARTICLE | DOW GLOBAL TECHNOLOGIES LLC | 2009-12-03 | — | — | US | disclosed |