⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6038444 | 1.00 | — | — | |
| SCHEMBL6671690 | 0.81 | — | — | |
| SCHEMBL9651313 | 0.81 | — | — | |
| SCHEMBL28666593 | 0.77 | — | — | |
| SCHEMBL27860724 | 0.75 | GRIK1 (0.31) | — | |
| SCHEMBL8767650 | 0.73 | GRIK1 (0.34) | — | |
| SCHEMBL8767655 | 0.73 | GRIK1 (0.34) | — | |
| SCHEMBL20924836 | 0.73 | ALDH1A1 (0.32) | — | |
| SCHEMBL14890939 | 0.72 | TP53 (0.40) | — | |
| SCHEMBL28529681 | 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-0264106-B1 | 5-Substituted amino-4-hydroxy-pentanoic acid derivatives and their use | BANYU PHARMA CO LTD (JP) | 1994-03-16 | — | — | EP | claimed |
| EP-0272583-A2 | 5-Substituted amino-4-hydroxy-pentenoic acid derivatives and their use | Banyu Pharmaceutical Co., Ltd. (JP) | 1988-06-29 | — | — | EP | disclosed |