⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16446110 | 0.92 | — | — | |
| SCHEMBL6124699 | 0.78 | — | — | |
| SCHEMBL6127867 | 0.78 | — | — | |
| SCHEMBL7961845 | 0.77 | — | — | |
| SCHEMBL10626674 | 0.75 | — | — | |
| SCHEMBL1286772 | 0.74 | MAPT (0.35) | — | |
| SCHEMBL11462716 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL10625733 | 0.72 | — | — | |
| Water SCHEMBL10625820 | 0.72 | — | — | |
| SCHEMBL16588572 | 0.72 | — | — |
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-2121570-A1 | PROCESS FOR THE REDUCTIVE AMINATION OF ALDEHYDES AND KETONES | Dow Global Technologies Inc. (US) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008076795-A1 | PROCESS FOR THE REDUCTIVE AMINATION OF ALDEHYDES AND KETONES | DOW GLOBAL TECHNOLOGIES INC. (US) | 2008-06-26 | — | — | WO | disclosed |