⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2019340 | 0.81 | TSHR (0.38) | — | |
| SCHEMBL11866338 | 0.77 | ALDH1A1 (0.40) | — | |
| SCHEMBL11866326 | 0.77 | ALDH1A1 (0.40) | — | |
| SCHEMBL27856342 | 0.77 | — | — | |
| SCHEMBL22988 | 0.75 | — | — | |
| SCHEMBL90556 | 0.74 | — | — | |
| SCHEMBL562764 | 0.73 | — | — | |
| SCHEMBL29037934 | 0.73 | — | — | |
| Ethylene SCHEMBL11309737 | 0.73 | — | — | |
| SCHEMBL6838931 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117836399-A | Layered construction with removable layers | 博伊西州立大学 | 2024-04-05 | — | — | CN | disclosed |
| WO-2012025460-A1 | OXADIAZOLINONE DERIVATIVES AND USE THEREOF IN PEST CONTROL | BAYER CROPSCIENCE AG (DE) | 2012-03-01 | — | — | WO | disclosed |
| CN-100377701-C | Permanent deformation of hair comprises applying a reducing composition containing sufficient metal and/or ammonium ions to precipitate an anionic or amphoteric polymer in situ | OREAL (FR) | 2008-04-02 | — | — | CN | disclosed |
| CN-1626058-A | Permanent deformation of hair comprises applying a reducing composition containing sufficient metal and/or ammonium ions to precipitate an anionic or amphoteric polymer in situ | OREAL (FR) | 2005-06-15 | — | — | CN | disclosed |
| EP-0971878-A1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2000-01-19 | — | — | EP | disclosed |
| WO-1998038156-A1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-03 | — | — | WO | disclosed |