⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17776399 | 0.81 | — | — | |
| SCHEMBL2025525 | 0.73 | — | — | |
| SCHEMBL8803 | 0.73 | — | — | |
| SCHEMBL17132951 | 0.72 | — | — | |
| SCHEMBL6056187 | 0.71 | — | — | |
| SCHEMBL6729003 | 0.71 | — | — | |
| SCHEMBL1415277 | 0.71 | — | — | |
| SCHEMBL22032822 | 0.71 | — | — | |
| SCHEMBL20602782 | 0.71 | — | — | |
| SCHEMBL4961301 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016081670-A2 | INSULIN RECEPTOR PARTIAL AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2016-05-26 | — | — | WO | disclosed |