⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10530939 | 0.93 | — | — | |
| SCHEMBL624173 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL388311 | 0.86 | — | — | |
| Hypochlorous Acid SCHEMBL31071035 | 0.76 | — | — | |
| Hypochlorous Acid SCHEMBL668627 | 0.76 | — | — | |
| Hypochlorous Acid SCHEMBL28332207 | 0.76 | — | — | |
| SCHEMBL13154178 | 0.71 | — | — | |
| Hypochlorous Acid SCHEMBL28854154 | 0.68 | — | — | |
| Hypochlorous Acid SCHEMBL3686083 | 0.68 | — | — | |
| Hypochlorous Acid SCHEMBL29010167 | 0.68 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1896490-B1 | MONOIMINE LIGAND PLATINUM ANALOGS | BIONUMERIK PHARMACEUTICALS INC (US) | 2013-03-06 | — | — | EP | claimed |
| EP-1896490-A1 | MONOIMINE LIGAND PLATINUM ANALOGS | BIONUMERIK PHARMACEUTICALS, INC. (US) | 2008-03-12 | — | — | EP | disclosed |
| WO-2007005057-A1 | MONOIMINE LIGAND PLATINUM ANALOGS | BIONUMERIK PHARMACEUTICALS, INC. (US) | 2007-01-11 | — | — | WO | disclosed |