⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL410293 | 0.67 | KMT2A (0.45) | — | |
| SCHEMBL12541924 | 0.65 | L3MBTL1 (0.32) | — | |
| SCHEMBL411289 | 0.65 | ALDH1A1 (0.36) | — | |
| SCHEMBL13974183 | 0.64 | KDM4E (0.36) | — | |
| SCHEMBL20061357 | 0.64 | KMT2A (0.36) | — | |
| SCHEMBL2059421 | 0.64 | — | — | |
| SCHEMBL862484 | 0.62 | — | — | |
| SCHEMBL3321442 | 0.62 | CA12 (0.45) | — | |
| SCHEMBL13687250 | 0.62 | BAZ2B (0.37) | — | |
| SCHEMBL14436542 | 0.62 | CCR5 (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2922596-B1 | HETEROCYCLYL CARBOXAMIDES FOR TREATING VIRAL DISEASES | NOVADRUG LLC (US) | 2018-05-23 | — | — | EP | disclosed |