⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10703317 | 0.84 | — | — | |
| SCHEMBL10505991 | 0.80 | — | — | |
| SCHEMBL10069416 | 0.77 | — | — | |
| SCHEMBL16270 | 0.76 | KMT2A (0.30) | — | |
| SCHEMBL1923266 | 0.76 | KMT2A (0.30) | — | |
| SCHEMBL1201897 | 0.76 | KMT2A (0.30) | — | |
| SCHEMBL7957715 | 0.76 | KMT2A (0.30) | — | |
| SCHEMBL18454277 | 0.76 | KMT2A (0.30) | — | |
| SCHEMBL9496945 | 0.76 | KMT2A (0.30) | — | |
| SCHEMBL7960126 | 0.76 | KMT2A (0.30) | — |
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-0044421-B1 | DI- AND OLIGO-1,2,4-TRIAZOLIDINE-3,5 DIONES AND PROCESSES FOR THEIR PREPARATION | BAYER AG (DE) | 1983-08-24 | — | — | EP | disclosed |
| EP-0044421-A1 | Di- and oligo-1,2,4-triazolidine-3,5 diones and processes for their preparation | BAYER AG (DE) | 1982-01-27 | — | — | EP | disclosed |