⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10609089 | 0.90 | STAT3 (0.30) | — | |
| SCHEMBL4320778 | 0.84 | BCHE (0.36) | — | |
| SCHEMBL224501 | 0.83 | — | — | |
| SCHEMBL10360154 | 0.81 | ERBB2 (0.32) | — | |
| SCHEMBL38285 | 0.79 | NPC1 (0.33) | — | |
| SCHEMBL270828 | 0.79 | MGAM (0.33) | — | |
| SCHEMBL19206252 | 0.79 | ALDH1A1 (0.34) | — | |
| SCHEMBL9764668 | 0.78 | KDM4E (0.32) | — | |
| SCHEMBL9764619 | 0.78 | KDM4E (0.32) | — | |
| SCHEMBL9764162 | 0.78 | STAT3 (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5646420-A | Single electron transistor using protein | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 1997-07-08 | — | — | US | claimed |
| EP-1545512-A4 | METHODS FOR USING GOLD (III) COMPLEXES AS ANTI-TUMOR AND ANTI-HIV AGENTS | UNIV HONG KONG (CN) | 2008-07-02 | — | — | EP | disclosed |
| EP-1545512-A1 | METHODS FOR USING GOLD (III) COMPLEXES AS ANTI-TUMOR AND ANTI-HIV AGENTS | The University of Hong Kong (CN) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004024146-A1 | METHODS FOR USING GOLD (III) COMPLEXES AS ANTI-TUMOR AND ANTI-HIV AGENTS | THE UNIVERSITY OF HONG KONG (CN) | 2004-03-25 | — | — | WO | disclosed |
| US-5646420-A | Single electron transistor using protein | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 1997-07-08 | — | — | US | disclosed |