⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13894525 | 0.86 | — | — | |
| SCHEMBL14890613 | 0.84 | HTT (0.32) | — | |
| SCHEMBL7790728 | 0.83 | CYP2C19 (0.33) | — | |
| SCHEMBL11603166 | 0.80 | — | — | |
| SCHEMBL8252306 | 0.80 | CHRM2 (0.33) | — | |
| SCHEMBL11593719 | 0.77 | SERPINE1 (0.32) | — | |
| SCHEMBL12136170 | 0.75 | — | — | |
| SCHEMBL19266046 | 0.74 | ALDH1A1 (0.31) | — | |
| SCHEMBL7927506 | 0.73 | HTT (0.50) | — | |
| SCHEMBL22012650 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100160428-A1 | TREATMENT OF MITOCHONDRIA-RELATED DISEASES AND IMPROVEMENT OF AGE-RELATED METABOLIC DEFICITS | PROTEMIX CORPORATION LIMITED (NZ) | 2010-06-24 | — | — | US | disclosed |