⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20096016 | 0.80 | — | — | |
| SCHEMBL15959366 | 0.76 | — | — | |
| SCHEMBL14847485 | 0.74 | — | — | |
| SCHEMBL12062504 | 0.72 | — | — | |
| SCHEMBL10168003 | 0.71 | — | — | |
| SCHEMBL13881345 | 0.71 | — | — | |
| SCHEMBL12509883 | 0.71 | — | — | |
| SCHEMBL20063691 | 0.71 | — | — | |
| SCHEMBL17208912 | 0.71 | HTR2A (0.32) | — | |
| SCHEMBL6905771 | 0.71 | HTR2A (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3670519-A2 | CONDENSED CYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DISPLAY APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE | Samsung Display Co., Ltd. (KR) | 2020-06-24 | — | — | EP | disclosed |