⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4082360 | 0.77 | FBP1 (0.39) | — | |
| SCHEMBL251357 | 0.77 | MGMT (0.40) | — | |
| SCHEMBL9682640 | 0.74 | MGMT (0.39) | — | |
| SCHEMBL2404075 | 0.72 | — | — | |
| SCHEMBL16553362 | 0.72 | — | — | |
| SCHEMBL247102 | 0.72 | — | — | |
| SCHEMBL266567 | 0.72 | — | — | |
| SCHEMBL181927 | 0.72 | — | — | |
| SCHEMBL73652 | 0.72 | — | — | |
| SCHEMBL6485160 | 0.72 | KCNA5 (0.35) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117153295-B | Method and recognition system for non-targeted recognition of perfluoro compound homolog | 南京大学 | 2024-03-12 | — | — | CN | disclosed |
| CN-117153295-A | Method and recognition system for non-targeted recognition of perfluoro compound homolog | 南京大学 | 2023-12-01 | — | — | CN | disclosed |
| EP-0473224-B1 | Blends of polar polymers and electrically conductive dedoped polymers, process for preparing these blends and use of these blends for making electronic, optoelectrical, electrotechnical and electromechanical devices | SOLVAY (BE) | 1996-02-28 | — | — | EP | disclosed |
| EP-0473224-A1 | Blends of polar polymers and electrically conductive dedoped polymers, process for preparing these blends and use of these blends for making electronic, optoelectrical, electrotechnical and electromechanical devices | SOLVAY (Société Anonyme) (BE) | 1992-03-04 | — | — | EP | disclosed |