⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25532127 | 0.86 | GABRA1 (0.30) | — | |
| SCHEMBL24654885 | 0.84 | — | — | |
| SCHEMBL8130441 | 0.79 | KIF11 (0.33) | — | |
| SCHEMBL50658 | 0.77 | GABRA1 (0.35) | — | |
| SCHEMBL13010764 | 0.71 | KIF11 (0.33) | — | |
| SCHEMBL7379691 | 0.67 | KIF11 (0.31) | — | |
| SCHEMBL21720113 | 0.66 | GABRA1 (0.33) | — | |
| SCHEMBL16467657 | 0.63 | MPL (0.34) | — | |
| SCHEMBL10153919 | 0.63 | DAO (0.38) | — | |
| SCHEMBL26837815 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11820766-B2 | Monoacylglycerol lipase modulators | JANSSEN PHARMACEUTICA NV (BE) | 2023-11-21 | — | — | US | disclosed |
| US-20230145249-A1 | Monoacylglycerol Lipase Modulators | JANSSEN PHARMACEUTICA NV (BE) | 2023-05-11 | — | — | US | disclosed |