⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13734124 | 0.70 | — | — | |
| SCHEMBL10782915 | 0.69 | — | — | |
| SCHEMBL5707183 | 0.67 | — | — | |
| SCHEMBL5707187 | 0.67 | — | — | |
| SCHEMBL25948776 | 0.65 | — | — | |
| SCHEMBL24416129 | 0.63 | FDPS (0.33) | — | |
| SCHEMBL25948768 | 0.62 | FDPS (0.32) | — | |
| SCHEMBL20232921 | 0.60 | CYP2C9 (0.38) | — | |
| SCHEMBL24415263 | 0.59 | APLNR (0.30) | — | |
| SCHEMBL92503 | 0.58 | GABRA1 (0.56) | — |
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-11040976-B2 | Substrate selective inhibitors of insulin-degrading enzyme (IDE) and uses thereof | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2021-06-22 | — | — | US | disclosed |