⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL862543 | 0.72 | IDO1 (0.31) | — | |
| SCHEMBL862319 | 0.70 | IDO1 (0.30) | — | |
| SCHEMBL26326828 | 0.66 | — | — | |
| SCHEMBL12667569 | 0.64 | IDO1 (0.31) | — | |
| SCHEMBL77010 | 0.63 | IDO1 (0.35) | — | |
| SCHEMBL4097320 | 0.62 | KDM4E (0.30) | — | |
| SCHEMBL862418 | 0.61 | — | — | |
| SCHEMBL13757223 | 0.59 | IDO1 (0.50) | — | |
| SCHEMBL13299554 | 0.58 | KDM4E (0.57) | — | |
| SCHEMBL16621753 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8142908-B2 | Polymer light-emitting material comprising a conjugated polymer and compound exhibiting light emission from the triplet excited state and polymer light-emitting device using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-03-27 | — | — | US | disclosed |
| US-20070051922-A1 | Polymer light-emitting material and polymer light-emitting device | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-03-08 | — | — | US | disclosed |