⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16782650 | 0.81 | — | — | |
| SCHEMBL1978922 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL82591 | 0.72 | — | — | |
| SCHEMBL10352085 | 0.72 | ALDH1A1 (0.44) | — | |
| SCHEMBL2402865 | 0.72 | — | — | |
| SCHEMBL928138 | 0.72 | — | — | |
| SCHEMBL30416905 | 0.72 | — | — | |
| SCHEMBL2318030 | 0.71 | — | — | |
| SCHEMBL9238444 | 0.71 | — | — | |
| SCHEMBL29930352 | 0.71 | — | — |
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-0218249-B1 | PROCESS FOR THE PRODUCTION OF 3-AMINOPYRROLIDINES | Tokyo Kasei Kogyo Co., Ltd (JP) | 1992-08-12 | — | — | EP | disclosed |
| US-4785119-A | AMINATION, CYCLIZATION | TOKYO KASEI KOGYO CO., LTD. (JP) | 1988-11-15 | — | — | US | disclosed |