⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28882353 | 0.98 | — | — | |
| SCHEMBL1007991 | 0.78 | — | — | |
| SCHEMBL20135758 | 0.74 | — | — | |
| SCHEMBL10948448 | 0.74 | GOT1 (0.31) | — | |
| SCHEMBL28350841 | 0.74 | — | — | |
| SCHEMBL30368344 | 0.72 | — | — | |
| SCHEMBL27831600 | 0.72 | GOT1 (0.30) | — | |
| SCHEMBL10624075 | 0.70 | — | — | |
| SCHEMBL609580 | 0.70 | — | — | |
| SCHEMBL7033298 | 0.70 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110698945-A | Environment-friendly glass baking varnish and preparation method thereof | 刘艳蕊 | 2020-01-17 | — | — | CN | disclosed |
| US-5831039-A | Fiber reactive polyazo dyes containing two urea groups | DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) | 1998-11-03 | — | — | US | disclosed |
| EP-0872523-A2 | Fiber-reactive azo dyes, process for their preparation and the use thereof | DyStar Textilfarben GmbH & Co. Deutschland KG (DE) | 1998-10-21 | — | — | EP | disclosed |
| US-5086177-A | Chemical intermediate for herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 1992-02-04 | — | — | US | disclosed |
| US-4980469-A | Reacting isothiourea of nitrogen containing heterocycle with hydroxylamine derivative | BAYER AKTIENGESELLSCHAFT (DE) | 1990-12-25 | — | — | US | disclosed |
| EP-0217038-B1 | Benzo-[b]-1,4,5,7-dithiadiazepine-1,1,4,4-tetroxide derivatives | BAYER AG (DE) | 1989-06-07 | — | — | EP | disclosed |
| US-4726834-A | PRE- AND POSTEMERGENCE | BAYER AKTIENGESELLSCHAFT (DE) | 1988-02-23 | — | — | US | disclosed |
| EP-0217038-A1 | Benzo-[b]-1,4,5,7-dithiadiazepine-1,1,4,4-tetroxide derivatives | BAYER AG (DE) | 1987-04-08 | — | — | EP | disclosed |
| EP-0213378-A1 | 1-(2-Oxyaminosulfonylphenylsulfonyl)-3-triazinyl ureas | BAYER AG (DE) | 1987-03-11 | — | — | EP | disclosed |
| EP-0173956-A1 | Sulfonyl-guanidinotriazine derivatives | BAYER AG (DE) | 1986-03-12 | — | — | EP | disclosed |