⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL940932 | 0.81 | TSHR (0.36) | — | |
| SCHEMBL28164047 | 0.75 | CES1 (0.38) | — | |
| SCHEMBL31195333 | 0.75 | TSHR (0.40) | — | |
| SCHEMBL11751399 | 0.74 | CES1 (0.41) | — | |
| SCHEMBL29024410 | 0.74 | CES1 (0.41) | — | |
| Maleic Anhydride SCHEMBL28213246 | 0.74 | TSHR (0.43) | — | |
| SCHEMBL8950371 | 0.74 | CES1 (0.41) | — | |
| Maleic Anhydride SCHEMBL28909396 | 0.71 | MGLL (0.43) | — | |
| SCHEMBL10939897 | 0.70 | CYP4F2 (0.33) | — | |
| SCHEMBL5013568 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108473749-B | Polymers derived from norbornadiene and maleic anhydride and uses thereof | 住友电木株式会社 | 2019-11-26 | — | — | CN | disclosed |