⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7166676 | 0.97 | — | — | |
| SCHEMBL7592941 | 0.70 | NOS3 (0.40) | — | |
| SCHEMBL7592597 | 0.69 | NOS3 (0.39) | — | |
| SCHEMBL7594297 | 0.69 | NOS3 (0.39) | — | |
| SCHEMBL7592138 | 0.69 | — | — | |
| SCHEMBL15074779 | 0.69 | — | — | |
| SCHEMBL7593918 | 0.67 | NOS3 (0.37) | — | |
| SCHEMBL7593583 | 0.65 | NOS3 (0.35) | — | |
| SCHEMBL7597426 | 0.64 | NOS3 (0.34) | — | |
| SCHEMBL7596320 | 0.63 | NOS3 (0.38) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0663394-B1 | Process for preparing 5-aminodihydropyrrole, intermediate thereof and process for preparing said intermediate | SUMITOMO CHEMICAL CO (JP) | 2002-11-13 | — | — | EP | disclosed |
| US-5498725-A | Process for preparing 5-aminodihydropyrrole intermediate thereof and process for preparing said intermediate | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1996-03-12 | — | — | US | disclosed |
| EP-0663394-A1 | Process for preparing 5-aminodihydropyrrole, intermediate thereof and process for preparing said intermediate | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1995-07-19 | — | — | EP | disclosed |
| EP-0596963-A1 | PROCESS AND INTERMEDIATE PRODUCTS FOR THE PRODUCTION OF SUBSTITUTED 6-(3,5,6,7-TETRAHYDROPYRROLO 2,1-c] 1,2,4]THIADIAZOLE-3-YLIDENAMINO)-7-FLUORO-2H-1,4-BENZOXAZIN-3(4H)-ONES | SCHERING AKTIENGESELLSCHAFT (DE) | 1994-05-18 | — | — | EP | disclosed |
| WO-1993003043-A1 | PROCESS AND INTERMEDIATE PRODUCTS FOR THE PRODUCTION OF SUBSTITUTED 6-(3,5,6,7-TETRAHYDROPYRROLO[2,1-c][1,2,4]THIADIAZOLE-3-YLIDENAMINO)-7-FLUORO-2H-1,4-BENZOXAZIN-3(4H)-ONES | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-02-18 | — | — | WO | disclosed |