⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2304744 | 0.97 | — | — | |
| SCHEMBL9596038 | 0.97 | — | — | |
| SCHEMBL21495994 | 0.94 | — | — | |
| SCHEMBL441144 | 0.94 | — | — | |
| SCHEMBL9842273 | 0.91 | — | — | |
| SCHEMBL10431909 | 0.91 | — | — | |
| SCHEMBL108130 | 0.91 | — | — | |
| SCHEMBL9347264 | 0.91 | — | — | |
| SCHEMBL10822007 | 0.91 | — | — | |
| SCHEMBL9747616 | 0.91 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019181646-A1 | MACROMOLECULAR COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL INCLUDING MACROMOLECULAR COMPOUND, AND ORGANIC ELECTRONIC DEVICE INCLUDING ORGANIC SEMICONDUCTOR MATERIAL | 国立大学法人大阪大学 | 2019-09-26 | — | — | WO | disclosed |
| WO-2019181645-A1 | COMPOUND, PRECURSOR TO COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL INCLUDING COMPOUND, AND ORGANIC ELECTRONIC DEVICE INCLUDING ORGANIC SEMICONDUCTOR MATERIAL | 国立大学法人大阪大学 | 2019-09-26 | — | — | WO | disclosed |