⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8193240 | 0.72 | — | — | |
| SCHEMBL111805 | 0.69 | — | — | |
| SCHEMBL1498197 | 0.69 | — | — | |
| SCHEMBL11690937 | 0.69 | — | — | |
| SCHEMBL27631 | 0.67 | — | — | |
| SCHEMBL7773252 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL10596466 | 0.67 | — | — | |
| SCHEMBL1525991 | 0.67 | — | — | |
| SCHEMBL5696140 | 0.65 | — | — | |
| SCHEMBL4587386 | 0.63 | — | — |
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-0322633-B1 | MERCAPTO-ACYLAMINO ACID ANTIHYPERTENSIVES | SCHERING CORPORATION (US) | 1991-05-22 | — | — | EP | claimed |
| CN-114302744-A | Peptide conjugates of microtubule targeting agents as therapeutic agents | 赛博克萨3公司 | 2022-04-08 | — | — | CN | disclosed |