⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25614958 | 0.82 | — | — | |
| SCHEMBL25623850 | 0.80 | — | — | |
| SCHEMBL25614976 | 0.79 | — | — | |
| SCHEMBL25615005 | 0.78 | SLC6A3 (0.30) | — | |
| SCHEMBL24316431 | 0.77 | — | — | |
| SCHEMBL25614986 | 0.77 | PDK2 (0.31) | — | |
| SCHEMBL25614989 | 0.76 | — | — | |
| SCHEMBL24316402 | 0.75 | PDK2 (0.31) | — | |
| SCHEMBL25614971 | 0.75 | — | — | |
| SCHEMBL25620913 | 0.75 | CA12 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11800792-B2 | Organic compound with spirocyclic adamantane, and electronic element and electronic device using same | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2023-10-24 | — | — | US | disclosed |
| US-20230200215-A1 | ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2023-06-22 | — | — | US | disclosed |