⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23764143 | 0.76 | TNF (0.32) | — | |
| SCHEMBL16484562 | 0.76 | TNF (0.39) | — | |
| SCHEMBL16484517 | 0.75 | TNF (0.38) | — | |
| SCHEMBL16484518 | 0.75 | TNF (0.38) | — | |
| SCHEMBL16484454 | 0.73 | PIK3CA (0.40) | — | |
| SCHEMBL16484466 | 0.72 | PIK3CA (0.39) | — | |
| SCHEMBL23764261 | 0.71 | ERN1 (0.30) | — | |
| SCHEMBL16485315 | 0.71 | MAPK14 (0.36) | — | |
| SCHEMBL16485322 | 0.71 | TNF (0.39) | — | |
| SCHEMBL23764267 | 0.71 | SIGMAR1 (0.38) | — |
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-2907803-B1 | FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT | TORAY INDUSTRIES (JP) | 2021-08-18 | — | — | EP | disclosed |