⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18768374 | 0.81 | TSHR (0.30) | — | |
| SCHEMBL110978 | 0.81 | TSHR (0.30) | — | |
| SCHEMBL110979 | 0.81 | TSHR (0.30) | — | |
| SCHEMBL11101779 | 0.79 | BTN3A1 (0.36) | — | |
| SCHEMBL11101778 | 0.79 | BTN3A1 (0.36) | — | |
| SCHEMBL11692535 | 0.77 | — | — | |
| SCHEMBL29022266 | 0.76 | SQLE (0.42) | — | |
| SCHEMBL108436 | 0.75 | — | — | |
| SCHEMBL22332687 | 0.74 | — | — | |
| SCHEMBL16810248 | 0.73 | — | — |
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-2428512-A2 | Fluorene compound, light-emitting element, light-emitting device, electronic device and lighting device | SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) | 2012-03-14 | — | — | EP | disclosed |