⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL75780 | 0.70 | — | — | |
| SCHEMBL22988689 | 0.70 | — | — | |
| Water SCHEMBL11130078 | 0.67 | — | — | |
| SCHEMBL1719672 | 0.67 | — | — | |
| SCHEMBL9191112 | 0.67 | — | — | |
| SCHEMBL9190741 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL11305307 | 0.64 | — | — | |
| SCHEMBL1577361 | 0.64 | — | — | |
| SCHEMBL76453 | 0.64 | — | — | |
| SCHEMBL12161098 | 0.64 | — | — |
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-1348691-A1 | PROCESS FOR PRODUCING ALPHA-AMINOHALOMETHYL KETONE DERIVATIVES | Ajinomoto Co., Inc. (JP) | 2003-10-01 | — | — | EP | disclosed |
| US-6538160-B2 | Process for producing α-aminohalomethyl ketone derivatives | AJINOMOTO CO., INC. (JP) | 2003-03-25 | — | — | US | disclosed |
| US-20020035296-A1 | Process for producing alpha-aminohalomethyl ketone derivatives | AJINOMOTO CO., INC. (JP) | 2002-03-21 | — | — | US | disclosed |