⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8966771 | 0.89 | — | — | |
| SCHEMBL27732056 | 0.85 | GGPS1 (0.31) | — | |
| SCHEMBL11005686 | 0.83 | TSHR (0.35) | — | |
| SCHEMBL56625 | 0.83 | — | — | |
| SCHEMBL4406661 | 0.83 | — | — | |
| SCHEMBL3825543 | 0.78 | TSHR (0.32) | — | |
| SCHEMBL331183 | 0.78 | TSHR (0.32) | — | |
| Isobutane SCHEMBL2511651 | 0.75 | TSHR (0.33) | — | |
| Isobutane SCHEMBL1812521 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL27632550 | 0.74 | TSHR (0.35) | — |
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-111372617-B | Tissue adhesive sealant device | 聚合物器官 IP 股份有限公司 | 2023-02-17 | — | — | CN | disclosed |