⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10553508 | 0.97 | ALDH1A1 (0.53) | — | |
| Hydrogen Peroxide SCHEMBL27498555 | 0.97 | — | — | |
| SCHEMBL23108 | 0.97 | — | — | |
| SCHEMBL9335555 | 0.97 | ALDH1A1 (0.53) | — | |
| SCHEMBL10554896 | 0.97 | ALDH1A1 (0.53) | — | |
| SCHEMBL9860296 | 0.93 | — | — | |
| Ammonia Solution, Strong SCHEMBL462357 | 0.93 | — | — | |
| SCHEMBL2536499 | 0.93 | — | — | |
| Methane SCHEMBL20636856 | 0.93 | — | — | |
| SCHEMBL5908818 | 0.93 | ALDH1A1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7119217-B2 | group III compounds such as gallium tripalmitate, used for prophylaxis of bone and autoimmune disorders, as antiinflammatory or anticarcinogernic agents | GENTA INCORPORATED (US) | 2006-10-10 | — | — | US | disclosed |
| US-20050261366-A1 | Tri(alkylcarboxylato)gallium (III) products and pharmaceutical compositions containing them | GENTA INCORPORATED | 2005-11-24 | — | — | US | disclosed |
| WO-2004026267-A2 | TRI(ALKYLCARBOXYLATO) GALLIUM (III) PRODUCTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GENTA INC. (US) | 2004-04-01 | — | — | WO | disclosed |