⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28049044 | 0.82 | — | — | |
| SCHEMBL27771064 | 0.80 | TDO2 (0.30) | — | |
| SCHEMBL27960566 | 0.80 | — | — | |
| SCHEMBL28040679 | 0.77 | — | — | |
| SCHEMBL27874172 | 0.77 | — | — | |
| SCHEMBL7256778 | 0.75 | — | — | |
| SCHEMBL27819207 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL29239614 | 0.74 | TSHR (0.42) | — | |
| SCHEMBL28024657 | 0.73 | — | — | |
| SCHEMBL27614328 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102725298-B | Hydroxy-substituted gold (III) porphyrin complexes as histone deacetylase inhibitors | UNIV HONG KONG | 2015-07-01 | — | — | CN | claimed |
| CN-102725298-A | Hydroxy-substituted gold (III) porphyrin complexes as histone deacetylase inhibitors | UNIV HONG KONG | 2012-10-10 | — | — | CN | claimed |
| CN-102725298-B | Hydroxy-substituted gold (III) porphyrin complexes as histone deacetylase inhibitors | UNIV HONG KONG | 2015-07-01 | — | — | CN | disclosed |
| CN-102725298-A | Hydroxy-substituted gold (III) porphyrin complexes as histone deacetylase inhibitors | UNIV HONG KONG | 2012-10-10 | — | — | CN | disclosed |