⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30100857 | 0.84 | — | — | |
| SCHEMBL16167765 | 0.81 | — | — | |
| SCHEMBL16167757 | 0.75 | — | — | |
| SCHEMBL672155 | 0.73 | CA1 (0.36) | — | |
| SCHEMBL16167760 | 0.72 | — | — | |
| SCHEMBL15641921 | 0.70 | — | — | |
| SCHEMBL1758677 | 0.69 | — | — | |
| SCHEMBL16167763 | 0.69 | — | — | |
| SCHEMBL1824607 | 0.69 | — | — | |
| SCHEMBL16167755 | 0.68 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115536702-A | Phosphonic acid difluoro alkyl ester methylene oxygen group pentafluoro ring triphosphazene compound and its preparation | 张家港市国泰华荣化工新材料有限公司 | 2022-12-30 | — | — | CN | disclosed |