⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL440143 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL377049 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL976968 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL1028079 | 0.72 | TSHR (0.38) | — | |
| SCHEMBL7186853 | 0.66 | TSHR (0.40) | — | |
| SCHEMBL14157251 | 0.66 | TSHR (0.40) | — | |
| SCHEMBL1131 | 0.66 | TSHR (0.40) | — | |
| SCHEMBL37123 | 0.66 | TSHR (0.40) | — | |
| SCHEMBL131268 | 0.66 | — | — | |
| SCHEMBL25206988 | 0.64 | TSHR (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-120039829-A | Method for purifying hydrogen chloride in fluorine-containing hydrogen chloride tail gas | 万华化学集团股份有限公司 | 2025-05-27 | — | — | CN | claimed |
| CN-120039829-A | Method for purifying hydrogen chloride in fluorine-containing hydrogen chloride tail gas | 万华化学集团股份有限公司 | 2025-05-27 | — | — | CN | disclosed |