⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19142402 | 1.00 | — | — | |
| SCHEMBL21755881 | 0.79 | TSHR (0.35) | — | |
| SCHEMBL1834611 | 0.76 | TDP1 (0.36) | — | |
| SCHEMBL20526404 | 0.76 | TDP1 (0.36) | — | |
| SCHEMBL1845796 | 0.76 | TDP1 (0.36) | — | |
| SCHEMBL3291304 | 0.76 | TDP1 (0.36) | — | |
| SCHEMBL20509901 | 0.76 | TDP1 (0.36) | — | |
| SCHEMBL6690910 | 0.76 | TDP1 (0.36) | — | |
| SCHEMBL1840460 | 0.76 | TDP1 (0.36) | — | |
| SCHEMBL27583386 | 0.76 | TDP1 (0.36) | — |
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-3498469-B1 | LAMINATE CONTAINING POLYCARBONATE COMPOSITION LAYERS AND FIBER STRUCTURE LAYERS WITH IMPROVED FIRE RESISTANCE PROPERTIES | TRINSEO EUROPE GMBH (CH) | 2021-12-01 | — | — | EP | disclosed |