⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13564613 | 0.88 | RORC (0.33) | — | |
| SCHEMBL18330268 | 0.87 | — | — | |
| SCHEMBL13196161 | 0.86 | MEN1 (0.31) | — | |
| SCHEMBL13354743 | 0.83 | — | — | |
| SCHEMBL14327672 | 0.81 | — | — | |
| SCHEMBL14682698 | 0.78 | MAPT (0.34) | — | |
| SCHEMBL13426475 | 0.78 | — | — | |
| SCHEMBL10352856 | 0.78 | MAPT (0.37) | — | |
| SCHEMBL17248124 | 0.77 | KDM4E (0.31) | — | |
| SCHEMBL880155 | 0.75 | RORC (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2537875-A1 | NOVEL POLYAZOMETHINE | Soken Chemical & Engineering Co., Ltd. (JP) | 2012-12-26 | — | — | EP | disclosed |
| US-20110114890-A1 | COMPOSITION CONTAINING A METAL COMPLEX AND ORGANIC COMPOUND, AND LIGHT-EMITTING ELEMENT USING SAID COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-05-19 | — | — | US | disclosed |
| EP-2048176-A1 | POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE | Sumitomo Chemical Company, Limited (JP) | 2009-04-15 | — | — | EP | disclosed |