⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12160787 | 0.79 | — | — | |
| SCHEMBL8633430 | 0.79 | — | — | |
| SCHEMBL116416 | 0.75 | — | — | |
| SCHEMBL13866763 | 0.74 | — | — | |
| SCHEMBL6704060 | 0.70 | — | — | |
| SCHEMBL333796 | 0.70 | — | — | |
| SCHEMBL18011037 | 0.70 | — | — | |
| SCHEMBL10049930 | 0.70 | — | — | |
| SCHEMBL23551933 | 0.69 | — | — | |
| SCHEMBL10171604 | 0.69 | KDM4E (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160164047-A1 | Composition for Forming Films, Film Produced from Said Composition, and Method for Producing Organic Semiconductor Element Using Said Composition | CENTRAL GLASS COMPANY, LIMITED | 2016-06-09 | — | — | US | disclosed |