⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20158324 | 0.77 | TSHR (0.40) | — | |
| SCHEMBL1267257 | 0.69 | — | — | |
| SCHEMBL4119428 | 0.69 | — | — | |
| SCHEMBL15447175 | 0.67 | — | — | |
| SCHEMBL12430912 | 0.67 | — | — | |
| SCHEMBL1343515 | 0.67 | — | — | |
| SCHEMBL13333875 | 0.63 | — | — | |
| SCHEMBL18606912 | 0.63 | — | — | |
| Carbon Monoxide SCHEMBL9304681 | 0.63 | — | — | |
| SCHEMBL8962270 | 0.63 | KMT2A (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 |
|---|---|---|---|---|---|---|---|
| US-20180134674-A1 | MAGL INHIBITORS | H. LUNDBECK A/S (DK) | 2018-05-17 | — | — | US | disclosed |