⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9926628 | 0.86 | — | — | |
| SCHEMBL6771053 | 0.85 | TMEM97 (0.31) | — | |
| SCHEMBL890997 | 0.84 | — | — | |
| SCHEMBL5211514 | 0.75 | — | — | |
| SCHEMBL6856420 | 0.74 | — | — | |
| SCHEMBL15901339 | 0.74 | CYP2D6 (0.31) | — | |
| SCHEMBL6862806 | 0.74 | — | — | |
| SCHEMBL15907972 | 0.74 | — | — | |
| SCHEMBL7038927 | 0.74 | — | — | |
| SCHEMBL5209811 | 0.73 | — | — |
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-113227177-A | High refractive index composition and use thereof | PPG工业俄亥俄公司 | 2021-08-06 | — | — | CN | disclosed |
| US-20020120097-A1 | Selenium-containing transparent optical material | OKAZAKI KOJU (JP) | 2002-08-29 | — | — | US | disclosed |