⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11758114 | 0.72 | — | — | |
| SCHEMBL8586597 | 0.67 | TSHR (0.33) | — | |
| SCHEMBL250774 | 0.67 | TSHR (0.33) | — | |
| SCHEMBL9245799 | 0.64 | — | — | |
| SCHEMBL5881387 | 0.61 | — | — | |
| SCHEMBL722325 | 0.61 | — | — | |
| SCHEMBL5881380 | 0.61 | — | — | |
| SCHEMBL1478783 | 0.61 | — | — | |
| SCHEMBL215409 | 0.61 | — | — | |
| SCHEMBL1072463 | 0.61 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105418927-B | A kind of low-dielectric constant film and preparation method thereof | 中国科学院上海高等研究院 | 2019-01-22 | — | — | CN | claimed |
| CN-106137774-B | Pit and fissure sealant based on tooth surface hydrophobization concept | 浙江大学 | 2020-04-17 | — | — | CN | disclosed |
| CN-109467705-A | A kind of amino acidic group helix poly silane infrared absorbing material and preparation method thereof | 东南大学 | 2019-03-15 | — | — | CN | disclosed |
| CN-104804030-B | Support type α diimine compounds and its application in olefin polymerization | 天津工业大学 | 2017-06-06 | — | — | CN | disclosed |
| CN-106137774-A | Pit and fissure sealant based on Tooth surface hydrophobization theory | 浙江大学 | 2016-11-23 | — | — | CN | disclosed |
| CN-104804030-A | Supported alpha-diimine compound and application of supported alpha-diimine compound in olefin polymerization | UNIV TIANJIN POLYTECHNIC | 2015-07-29 | — | — | CN | disclosed |
| US-6979413-B2 | Optical recording material | ASAHI GLASS COMPANY, LIMITED (JP) | 2005-12-27 | — | — | US | disclosed |
| US-20040166424-A1 | Optical recording material | ASAHI GLASS COMPANY, LIMITED (JP) | 2004-08-26 | — | — | US | disclosed |
| EP-1422554-A1 | OPTICAL RECORDING MATERIAL | ASAHI GLASS COMPANY LTD. (JP) | 2004-05-26 | — | — | EP | disclosed |