⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11513161 | 0.97 | — | — | |
| SCHEMBL9320841 | 0.84 | MEN1 (0.55) | — | |
| SCHEMBL17266170 | 0.75 | ALDH1A1 (0.40) | — | |
| SCHEMBL28668591 | 0.73 | — | — | |
| Triethylene Glycol SCHEMBL9320833 | 0.73 | ALDH1A1 (0.48) | — | |
| SCHEMBL28586082 | 0.73 | — | — | |
| SCHEMBL35692 | 0.73 | — | — | |
| SCHEMBL17266168 | 0.71 | CA12 (0.38) | — | |
| SCHEMBL21215048 | 0.71 | ALDH1A1 (0.38) | — | |
| SCHEMBL21611788 | 0.71 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115651188-A | RAFT chain transfer agent, preparation method and application thereof | 南方科技大学 | 2023-01-31 | — | — | CN | disclosed |
| CN-105597942-B | A kind of collecting agent and its application in fine fraction gold ore flotation | 西北有色地质矿业集团有限公司 | 2018-05-25 | — | — | CN | disclosed |
| EP-0383811-B1 | METHOD FOR REGULATING PLANT GROWTH USING XANTHATES | CPC INTERNATIONAL INC (US) | 1994-01-12 | — | — | EP | disclosed |
| EP-0383811-A4 | METHOD FOR REGULATING PLANT GROWTH USING XANTHATES | — | 1990-10-24 | — | — | EP | disclosed |
| EP-0383811-A1 | METHOD FOR REGULATING PLANT GROWTH USING XANTHATES. | CPC INTERNATIONAL INC (US) | 1990-08-29 | — | — | EP | disclosed |
| WO-1989003383-A1 | METHOD FOR REGULATING PLANT GROWTH USING XANTHATES | CPC INTERNATIONAL INC. (US) | 1989-04-20 | — | — | WO | disclosed |
| US-4141846-A | XANTHATE-SUBSTITUTED SULFUR-BRIDGED RINGS, ODORLESS | EDWIN COOPER AND COMPANY LIMITED (GB) | 1979-02-27 | — | — | US | disclosed |