⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26225352 | 0.82 | — | — | |
| SCHEMBL24196686 | 0.82 | — | — | |
| SCHEMBL2265260 | 0.79 | TPMT (0.31) | — | |
| SCHEMBL2265262 | 0.79 | TPMT (0.31) | — | |
| SCHEMBL26174523 | 0.79 | CYP3A4 (0.30) | — | |
| SCHEMBL23268459 | 0.77 | — | — | |
| SCHEMBL26225283 | 0.76 | TTR (0.42) | — | |
| SCHEMBL18725004 | 0.73 | TTR (0.30) | — | |
| SCHEMBL4175398 | 0.73 | TTR (0.30) | — | |
| SCHEMBL8049705 | 0.71 | CYP3A4 (0.33) | — |
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-2023012202-A1 | SWITCHING LAYERS FOR USE IN A WINDOW ELEMENT | MERCK PATENT GMBH (DE) | 2023-02-09 | — | — | WO | disclosed |
| US-10655066-B2 | Optical isomer | DIC CORPORATION (JP) | 2020-05-19 | — | — | US | disclosed |
| US-20180037819-A1 | OPTICAL ISOMER | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) | 2018-02-08 | — | — | US | disclosed |