⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11761117 | 1.00 | — | — | |
| SCHEMBL25140672 | 1.00 | — | — | |
| SCHEMBL5758542 | 0.76 | — | — | |
| SCHEMBL7535418 | 0.76 | — | — | |
| SCHEMBL7929117 | 0.73 | — | — | |
| SCHEMBL15906474 | 0.71 | — | — | |
| SCHEMBL15435902 | 0.71 | — | — | |
| SCHEMBL48073 | 0.71 | — | — | |
| SCHEMBL13285360 | 0.67 | — | — | |
| SCHEMBL4132028 | 0.66 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023061379-A2 | METHOD FOR PREPARING SULPHUR-CONTAINING POLYMER BASED ON ISOMERISATION-DRIVEN IRREVERSIBLE RING-OPENING POLYMERISATION | 中国科学院上海有机化学研究所 | 2023-04-20 | — | — | WO | disclosed |
| WO-2023061379-A2 | METHOD FOR PREPARING SULPHUR-CONTAINING POLYMER BASED ON ISOMERISATION-DRIVEN IRREVERSIBLE RING-OPENING POLYMERISATION | 中国科学院上海有机化学研究所 | 2023-04-20 | — | — | WO | disclosed |
| CN-115960355-A | Method for preparing sulfur-containing polymer based on isomerization-driven irreversible ring-opening polymerization | 中国科学院上海有机化学研究所 | 2023-04-14 | — | — | CN | disclosed |