⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL115951 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL29059238 | 0.78 | AGER (0.64) | — | |
| Hydrochloric Acid SCHEMBL28995499 | 0.78 | AGER (0.64) | — | |
| Acetic Acid Methyl Ester SCHEMBL10387561 | 0.74 | AGER (0.59) | — | |
| Trifluoroacetic Acid SCHEMBL29366000 | 0.70 | MEN1 (0.58) | — | |
| Trifluoroacetic Acid SCHEMBL29744983 | 0.70 | MEN1 (0.58) | — | |
| SCHEMBL2656302 | 0.67 | AGER (0.51) | — | |
| SCHEMBL31247565 | 0.67 | LMNA (0.44) | — | |
| SCHEMBL564354 | 0.65 | — | — | |
| SCHEMBL9715384 | 0.64 | HTT (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4249475-A1 | COMPOUND HAVING INHIBITORY ACTIVITY AGAINST O-GLCNACASE AND USE THEREOF | MEDIFRON DBT INC. (KR) | 2023-09-27 | — | — | EP | claimed |