⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1534107 | 0.75 | — | — | |
| Ammonia Solution, Strong SCHEMBL9801972 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL29238604 | 0.72 | — | — | |
| SCHEMBL7510469 | 0.64 | — | — | |
| SCHEMBL626354 | 0.64 | — | — | |
| SCHEMBL2570729 | 0.61 | — | — | |
| SCHEMBL1669878 | 0.61 | — | — | |
| SCHEMBL299720 | 0.59 | — | — | |
| SCHEMBL11017714 | 0.59 | — | — | |
| SCHEMBL16401948 | 0.58 | CYP2C19 (0.44) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6906224-B2 | Process for producing α-aminoketones | AJINOMOTO CO., INC. (JP) | 2005-06-14 | — | — | US | disclosed |
| US-20040210089-A1 | Process for producing alpha-aminoketones | AJINOMOTO CO., INC. (JP) | 2004-10-21 | — | — | US | disclosed |
| US-6696571-B2 | REACTING A 3-OXAZOLIDIN-5-ONE DERIVATIVE WITH A HALOMETHYL LITHIUM AND THEN TREATING WITH AN ACID | AJINOMOTO CO., INC. (JP) | 2004-02-24 | — | — | US | disclosed |
| EP-1348691-A1 | PROCESS FOR PRODUCING ALPHA-AMINOHALOMETHYL KETONE DERIVATIVES | Ajinomoto Co., Inc. (JP) | 2003-10-01 | — | — | EP | disclosed |
| US-20030100796-A1 | Process for producing alpha-aminoketones | AJINOMOTO CO., INC. (JP) | 2003-05-29 | — | — | US | disclosed |
| US-6570039-B2 | Oxazolidine compounds as chemical intermediates | AJINOMOTO CO., INC. (JP) | 2003-05-27 | — | — | US | 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 |
| US-20020035288-A1 | Process for producing alpha-aminoketones | AJINOMOTO CO., INC. (JP) | 2002-03-21 | — | — | US | disclosed |