⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18050649 | 1.00 | — | — | |
| SCHEMBL9937148 | 0.80 | LMNA (0.31) | — | |
| SCHEMBL30440549 | 0.80 | LMNA (0.31) | — | |
| Hydrochloric Acid SCHEMBL25274167 | 0.79 | LMNA (0.31) | — | |
| SCHEMBL19872920 | 0.66 | PBK (0.36) | — | |
| SCHEMBL12592351 | 0.65 | CSNK2A1 (0.38) | — | |
| SCHEMBL5376352 | 0.65 | ALDH1A1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL31329224 | 0.64 | CSNK2A1 (0.37) | — | |
| SCHEMBL5440536 | 0.63 | LMNA (0.36) | — | |
| SCHEMBL10617981 | 0.62 | CSNK2A2 (0.33) | — |
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-3268373-B1 | TRICYCLIC DLK INHIBITORS AND USES THEREOF | HOFFMANN LA ROCHE (CH) | 2022-04-27 | — | — | EP | disclosed |