⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19878260 | 0.62 | — | — | |
| Dimethyl Sulfoxide SCHEMBL28218816 | 0.54 | — | — | |
| SCHEMBL22812301 | 0.52 | — | — | |
| SCHEMBL2240230 | 0.51 | — | — | |
| SCHEMBL21702544 | 0.51 | — | — | |
| SCHEMBL22812302 | 0.51 | — | — | |
| SCHEMBL16189170 | 0.50 | — | — | |
| SCHEMBL2704957 | 0.50 | — | — | |
| SCHEMBL11611011 | 0.50 | — | — | |
| SCHEMBL22337585 | 0.50 | NOS3 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3171420-A1 | ORGANIC SEMICONDUCTOR FILM FORMATION COMPOSITION, ORGANIC SEMICONDUCTOR ELEMENT, AND PRODUCTION METHOD THEREFOR | Fujifilm Corporation (JP) | 2017-05-24 | — | — | EP | disclosed |