⚠ 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 | |
|---|---|---|---|---|
| Piperidine SCHEMBL2052688 | 0.95 | ALDH1A1 (0.82) | — | |
| Pyrrolidine SCHEMBL31561673 | 0.95 | ALDH1A1 (0.80) | — | |
| SCHEMBL8253733 | 0.95 | ALDH1A1 (1.00) | — | |
| Piperidine SCHEMBL8435190 | 0.95 | ALDH1A1 (1.00) | — | |
| SCHEMBL6890150 | 0.95 | ALDH1A1 (1.00) | — | |
| Piperidine SCHEMBL11283826 | 0.95 | — | — | |
| SCHEMBL11508384 | 0.95 | ALDH1A1 (1.00) | — | |
| SCHEMBL21753221 | 0.95 | ALDH1A1 (1.00) | — | |
| Piperidine SCHEMBL21819962 | 0.95 | ALDH1A1 (1.00) | — | |
| SCHEMBL3069642 | 0.95 | ALDH1A1 (1.00) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117374158-A | Preparation method of BC structure solar cell based on photoinduced doping | 扬州大学 | 2024-01-09 | — | — | CN | disclosed |
| EP-1678135-B1 | PROCESS FOR THE PREPARATION OF N-AMINO SUBSTITUTED HETEROCYCLIC COMPOUNDS | AVENTIS PHARMA INC (US) | 2009-05-13 | — | — | EP | disclosed |
| US-7112682-B2 | Process for the preparation of N-amino substituted heterocyclic compounds | AVENTIS PHARMACEUTICALS INC. (US) | 2006-09-26 | — | — | US | disclosed |
| EP-1678135-A1 | PROCESS FOR THE PREPARATION OF N-AMINO SUBSTITUTED HETEROCYCLIC COMPOUNDS | Aventis Pharmaceuticals, Inc. (US) | 2006-07-12 | — | — | EP | disclosed |
| US-20050101654-A1 | Process for the preparation of N-amino substituted heterocyclic compounds | AVENTIS PHARMACEUTICALS INC. (US) | 2005-05-12 | — | — | US | disclosed |
| WO-2005035496-A1 | PROCESS FOR THE PREPARATION OF N-AMINO SUBSTITUTED HETEROCYCLIC COMPOUNDS | AVENTIS PHARMACEUTICALS INC. (US) | 2005-04-21 | — | — | WO | disclosed |