⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20155900 | 0.65 | — | — | |
| SCHEMBL20155299 | 0.63 | — | — | |
| SCHEMBL21214207 | 0.53 | — | — | |
| SCHEMBL12973523 | 0.53 | — | — | |
| SCHEMBL13671266 | 0.53 | PHGDH (0.31) | — | |
| SCHEMBL13671265 | 0.53 | PHGDH (0.31) | — | |
| SCHEMBL8259406 | 0.53 | PHGDH (0.31) | — | |
| SCHEMBL23639834 | 0.50 | ATM (0.37) | — | |
| SCHEMBL18638070 | 0.47 | — | — | |
| SCHEMBL12697106 | 0.46 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180134675-A1 | MAGL INHIBITORS | H. LUNDBECK A/S (DK) | 2018-05-17 | — | — | US | disclosed |