⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL64072 | 0.74 | CYP3A4 (0.33) | — | |
| SCHEMBL28013221 | 0.73 | CYP3A4 (0.32) | — | |
| SCHEMBL27960253 | 0.73 | CYP3A4 (0.32) | — | |
| SCHEMBL28013804 | 0.73 | CYP3A4 (0.32) | — | |
| SCHEMBL4553769 | 0.73 | — | — | |
| SCHEMBL3908846 | 0.73 | — | — | |
| SCHEMBL3955049 | 0.73 | — | — | |
| SCHEMBL28819045 | 0.73 | CYP3A4 (0.32) | — | |
| SCHEMBL6131635 | 0.73 | — | — | |
| SCHEMBL30106704 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117919453-A | Preparation method of MRI/CT multi-mode probe | 中国科学院宁波材料技术与工程研究所 | 2024-04-26 | — | — | CN | claimed |
| CN-117919453-A | Preparation method of MRI/CT multi-mode probe | 中国科学院宁波材料技术与工程研究所 | 2024-04-26 | — | — | CN | disclosed |
| CN-117919453-A | Preparation method of MRI/CT multi-mode probe | 中国科学院宁波材料技术与工程研究所 | 2024-04-26 | — | — | CN | disclosed |
| WO-2011087995-A2 | ORGANIC COMPOUNDS | BARRY CLIFTON (US) | 2011-07-21 | — | — | WO | disclosed |
| US-20090124593-A1 | Pharmaceutical Compositions Primarily for the Treatment and Prevention of Genitourinary Infections and their ExtraGenital Complications | MARTON MILANKOVITS | 2009-05-14 | — | — | US | disclosed |
| US-20090074839-A1 | Pharmaceutical Compositions Primarily for the Treatment and Prevention of Genitourinary Infections and their Extragenital Complications | MILANKOVITS MARTON | 2009-03-19 | — | — | US | disclosed |
| US-20050208152-A1 | Pharmaceutical compositions primarily for the treatment and prevention of genitourinary infections and their extragenital complications | MILANKOVITS MARTON | 2005-09-22 | — | — | US | disclosed |
| US-4282232-A | Nitroimidazole radiosensitizers for hypoxic tumor cells and compositions thereof | RESEARCH CORPORATION (US) | 1981-08-04 | — | — | US | disclosed |