⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11425589 | 0.81 | — | — | |
| SCHEMBL28365912 | 0.71 | — | — | |
| SCHEMBL27367130 | 0.71 | — | — | |
| SCHEMBL28573774 | 0.65 | — | — | |
| Phosphine SCHEMBL29287678 | 0.65 | — | — | |
| SCHEMBL29199365 | 0.65 | — | — | |
| SCHEMBL28366642 | 0.64 | — | — | |
| SCHEMBL28370170 | 0.63 | — | — | |
| SCHEMBL2234700 | 0.63 | — | — | |
| SCHEMBL28366071 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117903297-A | Chemoselective coupling of sulfhydryl groups with alkenyl or alkynyl phosphoramides | 柏林合作研究学会 | 2024-04-19 | — | — | CN | disclosed |
| CN-109689112-B | Chemoselective coupling of sulfhydryl groups with alkenyl or alkynyl phosphoramides | 柏林合作研究学会 | 2023-10-13 | — | — | CN | disclosed |