⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13196161 | 0.94 | MEN1 (0.31) | — | |
| SCHEMBL12157078 | 0.85 | MAPT (0.37) | — | |
| SCHEMBL13426475 | 0.85 | — | — | |
| SCHEMBL10352856 | 0.85 | MAPT (0.37) | — | |
| SCHEMBL12657704 | 0.81 | — | — | |
| SCHEMBL12311816 | 0.79 | MEN1 (0.35) | — | |
| SCHEMBL13564613 | 0.79 | RORC (0.33) | — | |
| SCHEMBL13649897 | 0.78 | MEN1 (0.31) | — | |
| SCHEMBL14682708 | 0.78 | MAPT (0.32) | — | |
| SCHEMBL19177266 | 0.77 | KDM4E (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2693444-A1 | CONDUCTIVE COMPOSITION, CONDUCTIVE FILM USING CONDUCIVE COMPOSITION, AND METHOD FOR MANUFACTURING CONDUCTIVE FILM | FUJIFILM Corporation (JP) | 2014-02-05 | — | — | EP | disclosed |
| EP-2537875-A1 | NOVEL POLYAZOMETHINE | Soken Chemical & Engineering Co., Ltd. (JP) | 2012-12-26 | — | — | EP | disclosed |