⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5905735 | 0.75 | CCR1 (0.32) | — | |
| SCHEMBL134064 | 0.73 | — | — | |
| SCHEMBL8755276 | 0.71 | HSP90AA1 (0.31) | — | |
| SCHEMBL20604744 | 0.71 | LMNA (0.39) | — | |
| SCHEMBL92460 | 0.71 | — | — | |
| SCHEMBL16544557 | 0.69 | — | — | |
| SCHEMBL10039896 | 0.69 | CASP1 (0.46) | — | |
| SCHEMBL14282028 | 0.67 | PDK2 (0.34) | — | |
| SCHEMBL11023306 | 0.65 | — | — | |
| SCHEMBL12716504 | 0.65 | HRH4 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9660199-B2 | Compound, light-emitting material, and organic light-emitting device | KYULUX, INC. (JP) | 2017-05-23 | — | — | US | disclosed |
| US-20150041784-A1 | COMPOUND, LIGHT-EMITTING MATERIAL, AND ORGANIC LIGHT-EMITTING DEVICE | KYULUX, INC. (JP) | 2015-02-12 | — | — | US | disclosed |