⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1441833 | 0.65 | — | — | |
| SCHEMBL472031 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL7345378 | 0.60 | TDP1 (0.42) | — | |
| SCHEMBL1078973 | 0.60 | TDP1 (0.67) | — | |
| SCHEMBL28394174 | 0.60 | TDP1 (0.67) | — | |
| SCHEMBL11034127 | 0.60 | — | — | |
| SCHEMBL28773259 | 0.58 | — | — | |
| SCHEMBL21914891 | 0.57 | — | — | |
| Ethylene SCHEMBL8575909 | 0.55 | TDP1 (0.57) | — | |
| SCHEMBL16910012 | 0.55 | TDP1 (0.57) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6670468-B1 | Aminoalkylation at the 2' position | NOVARTIS AG (CH) | 2003-12-30 | — | — | US | disclosed |
| EP-0408945-A1 | Plasmides, their preparation and their use in obtaining a plasminogen activator | Grünenthal GmbH (DE) | 1991-01-23 | — | — | EP | disclosed |