⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16945371 | 0.77 | — | — | |
| Dichloroacetic Acid SCHEMBL7711952 | 0.77 | — | — | |
| SCHEMBL24339 | 0.77 | — | — | |
| SCHEMBL10791333 | 0.77 | — | — | |
| SCHEMBL852065 | 0.77 | — | — | |
| SCHEMBL1567548 | 0.77 | — | — | |
| SCHEMBL6916775 | 0.74 | — | — | |
| SCHEMBL6914397 | 0.74 | — | — | |
| L-Lactic Acid SCHEMBL14726306 | 0.74 | — | — | |
| SCHEMBL6917118 | 0.74 | — | — |
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-20090143363-A1 | Deuterated lorcaserin | CONCERT PHARMACEUTICALS, INC. (US) | 2009-06-04 | — | — | US | disclosed |