⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7459957 | 0.75 | — | — | |
| SCHEMBL8717792 | 0.73 | — | — | |
| SCHEMBL10452616 | 0.73 | — | — | |
| SCHEMBL10412012 | 0.64 | L3MBTL1 (0.35) | — | |
| Acetaldehyde SCHEMBL10837526 | 0.63 | TSHR (0.30) | — | |
| SCHEMBL15542337 | 0.60 | CHRNB2 (0.32) | — | |
| SCHEMBL15542630 | 0.60 | CHRNB2 (0.32) | — | |
| SCHEMBL50283 | 0.57 | L3MBTL1 (0.33) | — | |
| SCHEMBL14398026 | 0.57 | L3MBTL1 (0.33) | — | |
| SCHEMBL2038757 | 0.57 | L3MBTL1 (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 |
|---|---|---|---|---|---|---|---|
| EP-0431955-B1 | 3-Amino-2-hydroxybornane derivatives, asymmetric Michael reaction using the same, and process for preparing optically active muscone utilizing Michael reaction | NIPPON MINING CO (JP) | 1994-03-30 | — | — | EP | disclosed |
| EP-0431955-A2 | 3-Amino-2-hydroxybornane derivatives, asymmetric Michael reaction using the same, and process for preparing optically active muscone utilizing Michael reaction | NIKKO KYODO CO., LTD. (JP) | 1991-06-12 | — | — | EP | disclosed |