⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13444400 | 0.79 | — | — | |
| SCHEMBL13486649 | 0.75 | KDM4E (0.31) | — | |
| SCHEMBL13486660 | 0.75 | KDM4E (0.31) | — | |
| SCHEMBL13486667 | 0.63 | — | — | |
| SCHEMBL14877980 | 0.61 | — | — | |
| SCHEMBL13444358 | 0.60 | — | — | |
| SCHEMBL13486650 | 0.58 | — | — | |
| SCHEMBL12193838 | 0.57 | HSD17B10 (0.41) | — | |
| SCHEMBL18165618 | 0.56 | — | — | |
| SCHEMBL13486657 | 0.55 | — | — |
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-20110114888-A1 | PHOSPHORESENCE-EMITTING COMPOSITION, AND LIGHT-EMITTING ELEMENT UTILIZING THE COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-05-19 | — | — | US | disclosed |