⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14954817 | 0.73 | — | — | |
| SCHEMBL8149518 | 0.66 | — | — | |
| SCHEMBL17633963 | 0.65 | — | — | |
| SCHEMBL15720665 | 0.60 | — | — | |
| SCHEMBL21423912 | 0.58 | — | — | |
| SCHEMBL239887 | 0.43 | — | — | |
| SCHEMBL6765508 | 0.43 | — | — | |
| SCHEMBL9738500 | 0.41 | — | — | |
| SCHEMBL11730161 | 0.41 | — | — | |
| SCHEMBL23866 | 0.41 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0554244-A1 | ADAMANTANE POLYMERIC COMPOSITIONS | MOBIL OIL CORPORATION (US) | 1993-08-11 | — | — | EP | disclosed |
| WO-1992007018-A1 | ADAMANTANE POLYMERIC COMPOSITIONS | MOBIL OIL CORPORATION (US) | 1992-04-30 | — | — | WO | disclosed |
| US-5053434-A | Diamondoid polymeric compositions | MOBIL OIL CORPORATION (US) | 1991-10-01 | — | — | US | disclosed |