⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL49728 | 0.95 | LMNA (0.31) | — | |
| Hydrochloric Acid SCHEMBL1820282 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL11618183 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL11208123 | 0.87 | — | — | |
| SCHEMBL11042593 | 0.84 | — | — | |
| SCHEMBL5610286 | 0.81 | TSHR (0.40) | — | |
| SCHEMBL2214339 | 0.81 | TSHR (0.40) | — | |
| SCHEMBL5610680 | 0.81 | TSHR (0.40) | — | |
| SCHEMBL1668390 | 0.78 | — | — | |
| SCHEMBL1668595 | 0.78 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113896846-A | Hydrogenated polyisoprene-embedded-syndiotactic poly-fluoro-styryl hydrophobic elastomer and preparation method thereof | 大连理工大学 | 2022-01-07 | — | — | CN | claimed |
| EP-0921202-B1 | Method of forming metal matrix fiber composites | INCO LTD (CA) | 2003-05-21 | — | — | EP | claimed |
| CN-113896846-A | Hydrogenated polyisoprene-embedded-syndiotactic poly-fluoro-styryl hydrophobic elastomer and preparation method thereof | 大连理工大学 | 2022-01-07 | — | — | CN | disclosed |
| CN-1069094-C | Process for producing lanthanide metal carboxylate | QIMEI IND CO LTD (CN) | 2001-08-01 | — | — | CN | disclosed |
| CN-1230536-A | Process for producing lanthanide metal carboxylate | QIMEI IND CO LTD (CN) | 1999-10-06 | — | — | CN | disclosed |