⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25473260 | 0.78 | — | — | |
| SCHEMBL21387950 | 0.78 | — | — | |
| SCHEMBL19660983 | 0.78 | MAOA (0.40) | — | |
| SCHEMBL22992206 | 0.77 | BRD4 (0.33) | — | |
| SCHEMBL9604056 | 0.75 | CALM1 (0.35) | — | |
| SCHEMBL19035965 | 0.75 | — | — | |
| SCHEMBL20022915 | 0.75 | ALDH1A1 (0.36) | — | |
| SCHEMBL23052986 | 0.74 | — | — | |
| SCHEMBL20383361 | 0.74 | GAA (0.35) | — | |
| SCHEMBL19654617 | 0.74 | — | — |
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-20230157163-A1 | ORGANIC COMPOUND, PREPARATION METHOD THEREOF, AND DISPLAY PANEL | WUHAN CHINA STAR OPTOELECTRONICS SEMICONDUCTOR DISPLAY TECHNOLOGY CO., LTD. (CN) | 2023-05-18 | — | — | US | disclosed |