⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1271103 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL11883245 | 0.77 | HTR2A (0.41) | — | |
| SCHEMBL1271193 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL3230668 | 0.73 | KDM4E (0.33) | — | |
| SCHEMBL10496496 | 0.72 | MEN1 (0.37) | — | |
| SCHEMBL1493187 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL8908265 | 0.71 | SLC9A1 (0.32) | — | |
| SCHEMBL14955207 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL4271660 | 0.71 | SLC9A1 (0.32) | — | |
| SCHEMBL3238058 | 0.69 | ESR1 (0.34) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0282294-B1 | Vinylsilylalkoxy arylbenzotriazole compounds and UV absorbing compositions made therefrom | IOLAB CORP (US) | 1993-12-01 | — | — | EP | disclosed |
| US-4876363-A | NONHYDROLYZING COUPLERS | TOSHIBA SILICONE CO., LTD. (JP) | 1989-10-24 | — | — | US | disclosed |
| US-4803254-A | Vinylsilylalkoxy arylbenzotriazole compounds and UV absorbing compositions made therefrom | IOLAB CORPORATION (US) | 1989-02-07 | — | — | US | disclosed |
| EP-0282294-A2 | Vinylsilylalkoxy arylbenzotriazole compounds and UV absorbing compositions made therefrom | IOLAB CORPORATION (US) | 1988-09-14 | — | — | EP | disclosed |