⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27807325 | 0.98 | — | — | |
| SCHEMBL6061284 | 0.86 | RXRA (0.31) | — | |
| SCHEMBL211429 | 0.81 | DPP4 (0.35) | — | |
| SCHEMBL5996084 | 0.80 | L3MBTL1 (0.33) | — | |
| SCHEMBL11564080 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL11562599 | 0.79 | OPRM1 (0.33) | — | |
| SCHEMBL6053722 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL28812820 | 0.74 | CYP3A4 (0.32) | — | |
| SCHEMBL3148563 | 0.73 | — | — | |
| SCHEMBL10384406 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111278926-B | Curable silicone composition, resin sheet for optical member containing same, and light-emitting device | 陶氏东丽株式会社 | 2022-06-07 | — | — | CN | disclosed |
| CN-111278926-A | Curable silicone composition, resin sheet for optical member containing same, and light-emitting device | 陶氏东丽株式会社 | 2020-06-12 | — | — | CN | disclosed |