⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22518647 | 0.96 | TSHR (0.31) | — | |
| SCHEMBL29123585 | 0.96 | TSHR (0.31) | — | |
| SCHEMBL8863968 | 0.96 | — | — | |
| SCHEMBL6555111 | 0.96 | — | — | |
| SCHEMBL10431920 | 0.96 | TSHR (0.31) | — | |
| SCHEMBL25341864 | 0.92 | — | — | |
| SCHEMBL27495780 | 0.92 | — | — | |
| SCHEMBL20240045 | 0.92 | — | — | |
| SCHEMBL20972352 | 0.92 | TSHR (0.33) | — | |
| SCHEMBL333 | 0.92 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113512136-B | Method for reducing low-molecular-weight carboxyl-terminated fluorine-containing polymer by borohydride/diisobutylaluminum hydride reduction system | 大连海事大学 | 2022-06-28 | — | — | CN | claimed |
| CN-113512136-A | Method for reducing low-molecular-weight carboxyl-terminated fluorine-containing polymer by borohydride/diisobutylaluminum hydride reduction system | 大连海事大学 | 2021-10-19 | — | — | CN | claimed |
| CN-113512136-B | Method for reducing low-molecular-weight carboxyl-terminated fluorine-containing polymer by borohydride/diisobutylaluminum hydride reduction system | 大连海事大学 | 2022-06-28 | — | — | CN | disclosed |
| CN-113512136-B | Method for reducing low-molecular-weight carboxyl-terminated fluorine-containing polymer by borohydride/diisobutylaluminum hydride reduction system | 大连海事大学 | 2022-06-28 | — | — | CN | disclosed |
| CN-113512136-B | Method for reducing low-molecular-weight carboxyl-terminated fluorine-containing polymer by borohydride/diisobutylaluminum hydride reduction system | 大连海事大学 | 2022-06-28 | — | — | CN | disclosed |
| CN-113512136-A | Method for reducing low-molecular-weight carboxyl-terminated fluorine-containing polymer by borohydride/diisobutylaluminum hydride reduction system | 大连海事大学 | 2021-10-19 | — | — | CN | disclosed |
| CN-113512136-A | Method for reducing low-molecular-weight carboxyl-terminated fluorine-containing polymer by borohydride/diisobutylaluminum hydride reduction system | 大连海事大学 | 2021-10-19 | — | — | CN | disclosed |
| CN-113512136-A | Method for reducing low-molecular-weight carboxyl-terminated fluorine-containing polymer by borohydride/diisobutylaluminum hydride reduction system | 大连海事大学 | 2021-10-19 | — | — | CN | disclosed |