⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16569592 | 1.00 | — | — | |
| SCHEMBL2512513 | 0.68 | — | — | |
| SCHEMBL16830157 | 0.65 | — | — | |
| SCHEMBL989793 | 0.62 | — | — | |
| SCHEMBL342676 | 0.57 | — | — | |
| SCHEMBL20746081 | 0.57 | — | — | |
| SCHEMBL870141 | 0.57 | EPHX1 (0.53) | — | |
| SCHEMBL31303847 | 0.57 | EPHX1 (0.53) | — | |
| SCHEMBL23409394 | 0.55 | — | — | |
| Ammonia Solution, Strong SCHEMBL2286653 | 0.55 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3221300-A1 | ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES | Actelion Pharmaceuticals Ltd (CH) | 2017-09-27 | — | — | EP | claimed |
| WO-2016079688-A1 | ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2016-05-26 | — | — | WO | claimed |
| EP-3344630-A1 | SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS | Idorsia Pharmaceuticals Ltd (CH) | 2018-07-11 | — | — | EP | disclosed |
| EP-3334737-A1 | SUBSTITUTED 1,2-DIHYDRO-3H | Idorsia Pharmaceuticals Ltd (CH) | 2018-06-20 | — | — | EP | disclosed |
| EP-3143038-A1 | PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS | Ugisense AG (DE) | 2017-03-22 | — | — | EP | disclosed |
| WO-2017037221-A1 | SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS | ACTELION PHARMACEUTICALS LTD (CH) | 2017-03-09 | — | — | WO | disclosed |
| WO-2017025562-A1 | SUBSTITUTED 1,2-DIHYDRO-3H PYRROLO[1,2-c]IMIDAZOL-3 ONE ANTIBACTERIALS | ACTELION PHARMACEUTICALS LTD (CH) | 2017-02-16 | — | — | WO | disclosed |
| WO-2015172889-A1 | PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS | UGICHEM GMBH (AT) | 2015-11-19 | — | — | WO | disclosed |