⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27939233 | 0.77 | MEN1 (0.65) | — | |
| SCHEMBL9111720 | 0.76 | MEN1 (0.50) | — | |
| SCHEMBL70072 | 0.74 | — | — | |
| SCHEMBL28024577 | 0.74 | LMNA (1.00) | — | |
| SCHEMBL2435644 | 0.72 | — | — | |
| SCHEMBL10512466 | 0.72 | — | — | |
| SCHEMBL13570388 | 0.72 | MEN1 (0.59) | — | |
| SCHEMBL9229619 | 0.72 | — | — | |
| SCHEMBL13570389 | 0.72 | — | — | |
| SCHEMBL2999774 | 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-1167972-B1 | Enzyme catalyzed therapeutic agents | KIADIS PHARMA INTELLECTUAL PROPERTY B V (NL) | 2017-03-08 | — | — | EP | disclosed |
| US-7601703-B2 | Enzyme catalyzed therapeutic agents | CELMED ONCOLOGY (USA), INC. (CA) | 2009-10-13 | — | — | US | disclosed |