⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9251958 | 0.81 | SIRT2 (0.30) | — | |
| SCHEMBL2030791 | 0.80 | — | — | |
| SCHEMBL689258 | 0.76 | — | — | |
| SCHEMBL3817522 | 0.74 | — | — | |
| SCHEMBL2030415 | 0.73 | — | — | |
| SCHEMBL3948362 | 0.69 | — | — | |
| SCHEMBL8962854 | 0.69 | — | — | |
| SCHEMBL2231607 | 0.66 | — | — | |
| SCHEMBL7242684 | 0.66 | GRIN2D (0.31) | — | |
| SCHEMBL247813 | 0.64 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0647886-B1 | Polyesteramide-siloxane toner and developer compositions | XEROX CORP (US) | 2000-02-23 | — | — | EP | disclosed |
| EP-0647886-A1 | Polyesteramide-siloxane toner and developer compositions | XEROX CORPORATION (US) | 1995-04-12 | — | — | EP | disclosed |
| US-5401601-A | Polyesteramide-siloxane toner and developer compositions | XEROX CORPORATION (US) | 1995-03-28 | — | — | US | disclosed |