⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5057324 | 0.83 | — | — | |
| SCHEMBL3266280 | 0.80 | — | — | |
| SCHEMBL1059438 | 0.72 | — | — | |
| SCHEMBL8741525 | 0.72 | — | — | |
| SCHEMBL13086080 | 0.71 | — | — | |
| SCHEMBL7457089 | 0.70 | — | — | |
| SCHEMBL8741526 | 0.68 | TSHR (0.30) | — | |
| SCHEMBL285592 | 0.68 | TSHR (0.30) | — | |
| SCHEMBL19930034 | 0.67 | TSHR (0.32) | — | |
| Hydrochloric Acid SCHEMBL2951043 | 0.67 | — | — |
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-1700922-B1 | 3-Substituted 5-Nitroindole derivatives and labeled oligonucleotide probes containing them | ROCHE DIAGNOSTICS GMBH (DE) | 2016-08-24 | — | — | EP | disclosed |
| EP-1842923-B1 | Methanesulfonylaminoindole derivatives and labeled oligonucleotide probes containing them | ROCHE DIAGNOSTICS GMBH (DE) | 2015-07-15 | — | — | EP | disclosed |
| US-7759470-B2 | Labeling reagent | ROCHE DIAGNOSTICS OPERATIONS, INC. (US) | 2010-07-20 | — | — | US | disclosed |
| US-7759469-B2 | substituted indole nucleosides as both terminal as well as internal building blocks of labeled oligonucleotide probes for the detection, analysis and quantitation of nucleic acids; nucleoside with a 3-substituted methanesulfonylamino indole as nucleobase | ROCHE DIAGNOSTICS OPERATIONS, INC. (US) | 2010-07-20 | — | — | US | disclosed |
| EP-1842923-A1 | Methanesulfonylaminoindole derivatives and labeled oligonucleotide probes containing them. | Roche Diagnostics GmbH (DE) | 2007-10-10 | — | — | EP | disclosed |
| US-20070196852-A1 | Labeling reagent | ROCHE DIAGNOSTICS GMBH (DE) | 2007-08-23 | — | — | US | disclosed |
| US-20060216736-A1 | Labeling reagent | ROCHE DIAGNOSTICS OPERTIONS, INC. (US) | 2006-09-28 | — | — | US | disclosed |
| EP-1700922-A2 | Nitroindole derivatives and labeled oligonucleotide probes containing them | Roche Diagnostics GmbH (DE) | 2006-09-13 | — | — | EP | disclosed |