⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4611334 | 1.00 | — | — | |
| SCHEMBL3598285 | 1.00 | — | — | |
| SCHEMBL4730601 | 0.79 | — | — | |
| SCHEMBL1676698 | 0.74 | — | — | |
| SCHEMBL1676699 | 0.74 | — | — | |
| SCHEMBL11277663 | 0.74 | — | — | |
| SCHEMBL5579074 | 0.72 | — | — | |
| SCHEMBL3390700 | 0.72 | — | — | |
| SCHEMBL9632102 | 0.72 | — | — | |
| SCHEMBL7518752 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5030732-A | Antiacterial agents | MERCK & CO., INC. (US) | 1991-07-09 | — | — | US | disclosed |
| EP-0282219-B1 | AMINOETHYLPHOSPHINIC ACID DERIVATIVES | MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) | 1991-07-03 | — | — | EP | disclosed |
| EP-0282219-A1 | Aminoethylphosphinic acid derivatives | MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) | 1988-09-14 | — | — | EP | disclosed |
| EP-0105193-A2 | Spergualin-related compounds, processes for the preparation thereof and their use as medicaments | MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) | 1984-04-11 | — | — | EP | disclosed |
| US-4363800-A | PEPTIDES USEFUL AS ANTITUSSIVES AND AS ANTI-DIARRHDEALS | BURROUGHS WELLCOME CO. (US) | 1982-12-14 | — | — | US | disclosed |