⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL18007667 | 0.97 | — | — | |
| SCHEMBL18555379 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL9050360 | 0.90 | ALDH1A1 (0.31) | — | |
| SCHEMBL17096983 | 0.83 | — | — | |
| SCHEMBL44180 | 0.83 | TSHR (0.36) | — | |
| Hydrochloric Acid SCHEMBL432534 | 0.80 | TSHR (0.35) | — | |
| SCHEMBL43895 | 0.80 | SPHK2 (0.36) | — | |
| Hydrochloric Acid SCHEMBL120845 | 0.80 | TSHR (0.35) | — | |
| SCHEMBL44286 | 0.80 | SPHK2 (0.36) | — | |
| Hydrochloric Acid SCHEMBL3613960 | 0.78 | SPHK2 (0.35) | — |
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-11845715-B2 | — | — | 2023-12-19 | — | — | US | disclosed |
| US-20180044287-A1 | SULFONYLUREAS AND RELATED COMPOUNDS AND USE OF SAME | INFLAZOME LIMITED (IE) | 2018-02-15 | — | — | US | disclosed |