⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL38661865 | 0.60 | ALDH1A1 (0.41) | — | |
| SCHEMBL10735199 | 0.60 | ALDH1A1 (0.41) | — | |
| SCHEMBL9154541 | 0.58 | — | — | |
| SCHEMBL3606936 | 0.57 | MAPT (0.36) | — | |
| SCHEMBL10731858 | 0.55 | MEN1 (0.38) | — | |
| SCHEMBL7013277 | 0.54 | L3MBTL1 (0.44) | — | |
| SCHEMBL27731241 | 0.53 | PTPRC (0.30) | — | |
| SCHEMBL27655143 | 0.53 | L3MBTL1 (0.34) | — | |
| SCHEMBL10022032 | 0.52 | — | — | |
| SCHEMBL27514025 | 0.52 | KDM4E (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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1113009-A1 | A process for the manufacture of the salts of sulfonylaminocarbonyl triazolinones | Bayer Corporation (US) | 2001-07-04 | — | — | EP | disclosed |
| US-6160125-A | Process for the manufacture of sulfonylaminocarbonyl triazolinones in the presence of xylene as solvent | BAYER CORPORATION (US) | 2000-12-12 | — | — | US | disclosed |
| US-6147222-A | Process for the manufacture of sulfonylaminocarbonyl triazolinones and salts thereof under pH controlled conditions | BAYER CORPORATION (US) | 2000-11-14 | — | — | US | disclosed |
| US-6147221-A | Process for the manufacture of sulfonylaminocarbonyl triazolinones and salts thereof | BAYER CORPORATION (US) | 2000-11-14 | — | — | US | disclosed |
| US-5869681-A | PREPARING TRIAZOLINONE INTERMEDIATE BY HEATING HYDROCARBYLOXYCARBONYL-ISOSEMICARBAZIDE TO CYCLIZE | BAYER AKTIENGESELLSCHAFT (DE) | 1999-02-09 | — | — | US | disclosed |
| US-5534486-A | Herbicidal sulphonylaminocarbonyl triazolinones having substituents bonded via oxygen | BAYER AKTIENGESELLSCHAFT (DE) | 1996-07-09 | — | — | US | disclosed |