⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11188785 | 0.83 | KMT2A (0.37) | — | |
| SCHEMBL11189826 | 0.81 | — | — | |
| SCHEMBL11196508 | 0.75 | ACE (0.55) | — | |
| SCHEMBL11188904 | 0.75 | GAA (0.51) | — | |
| SCHEMBL11266045 | 0.72 | ACE (0.41) | — | |
| SCHEMBL11192009 | 0.70 | KMT2A (0.57) | — | |
| SCHEMBL11272933 | 0.67 | ACE (0.35) | — | |
| SCHEMBL11261862 | 0.61 | ACE (0.60) | — | |
| SCHEMBL11247800 | 0.61 | — | — | |
| SCHEMBL11189446 | 0.59 | GAA (0.44) | — |
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-4347371-A | HYPERTENSIVE AGENTS; ANTIDIABETIC AGENTS; VISION DEFECTS | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1982-08-31 | — | — | US | disclosed |