⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL117895 | 1.00 | — | — | |
| SCHEMBL29952845 | 0.82 | — | — | |
| SCHEMBL844320 | 0.82 | — | — | |
| SCHEMBL15741494 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL18492068 | 0.80 | GAA (0.40) | — | |
| SCHEMBL29955436 | 0.78 | KMT2A (0.46) | — | |
| SCHEMBL2600757 | 0.78 | KMT2A (0.46) | — | |
| SCHEMBL3661431 | 0.77 | — | — | |
| SCHEMBL15741456 | 0.77 | — | — | |
| SCHEMBL15741921 | 0.77 | — | — |
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-11739080-B2 | Matrix metalloproteinase (MMP) inhibitors and methods of use thereof | FORESEE PHARMACEUTICALS USA, INC. (US) | 2023-08-29 | — | — | US | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |