⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10706828 | 0.75 | — | — | |
| SCHEMBL601895 | 0.68 | — | — | |
| SCHEMBL1886237 | 0.68 | — | — | |
| SCHEMBL4352473 | 0.67 | — | — | |
| SCHEMBL7775536 | 0.66 | ALDH1A1 (0.32) | — | |
| SCHEMBL288790 | 0.66 | ALDH1A1 (0.32) | — | |
| SCHEMBL261063 | 0.60 | — | — | |
| SCHEMBL3684469 | 0.60 | — | — | |
| SCHEMBL17141201 | 0.60 | — | — | |
| SCHEMBL3231233 | 0.60 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080026314-A1 | Silane Compound, Polysiloxane, and Radiation-Sensitive Resin Composition | JSR CORPORATION (JP) | 2008-01-31 | — | — | US | disclosed |
| EP-1679314-A1 | SILANE COMPOUND, POLYSILOXANE AND RADIATION-SENSITIVE RESIN COMPOSITION | JSR Corporation (JP) | 2006-07-12 | — | — | EP | disclosed |