⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3757134 | 0.67 | — | — | |
| SCHEMBL10953174 | 0.67 | — | — | |
| SCHEMBL5485953 | 0.65 | — | — | |
| SCHEMBL8935001 | 0.65 | — | — | |
| SCHEMBL3384167 | 0.63 | — | — | |
| SCHEMBL1026227 | 0.61 | — | — | |
| SCHEMBL6887412 | 0.60 | — | — | |
| SCHEMBL3382986 | 0.60 | THRB (0.35) | — | |
| SCHEMBL3920964 | 0.59 | — | — | |
| SCHEMBL543942 | 0.58 | — | — |
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-119192231-A | Hydroxyl-containing organic phosphonate and preparation method and application thereof | 威海海润新材料科技有限公司 | 2024-12-27 | — | — | CN | disclosed |