⚠ 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 | |
|---|---|---|---|---|
| Ethephon SCHEMBL2787060 | 0.76 | TYMS (0.62) | — | |
| Ethephon SCHEMBL37574 | 0.76 | — | — | |
| SCHEMBL11424927 | 0.76 | — | — | |
| SCHEMBL19353622 | 0.74 | — | — | |
| Ethephon SCHEMBL11882517 | 0.73 | — | — | |
| Ethephon SCHEMBL10623685 | 0.73 | — | — | |
| Ethephon SCHEMBL21385094 | 0.73 | — | — | |
| Ethephon SCHEMBL28427222 | 0.73 | — | — | |
| SCHEMBL4860082 | 0.72 | — | — | |
| SCHEMBL11882569 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105085988-B | A kind of compositions of additives and its preparation method for polymer and the flame-proofed thermoplastic polymer in-mold moulding material being made from it | 肖群 | 2017-06-30 | — | — | CN | claimed |
| EP-0270041-B1 | PROCESS FOR PREPARING 2-CHLOROETHANEPHOSPHONIC-ACID DICHLORIDES | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-12-27 | — | — | EP | disclosed |
| US-3920439-A | 2-Chloroethylphosphonothioic acids and esters for regulation of plant growth | GAF BUILDING MATERIALS CORPORATION | 1975-11-18 | — | — | US | disclosed |