⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25140651 | 1.00 | — | — | |
| SCHEMBL10697669 | 0.69 | — | — | |
| SCHEMBL25140668 | 0.67 | — | — | |
| SCHEMBL25140590 | 0.67 | — | — | |
| SCHEMBL37255 | 0.67 | — | — | |
| SCHEMBL265331 | 0.67 | — | — | |
| SCHEMBL1106718 | 0.67 | — | — | |
| SCHEMBL265674 | 0.67 | — | — | |
| SCHEMBL5306053 | 0.67 | CA1 (1.00) | — | |
| SCHEMBL23444954 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| 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 |