⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1992898 | 0.61 | — | — | |
| Bromide SCHEMBL9840221 | 0.60 | — | — | |
| SCHEMBL19224625 | 0.57 | — | — | |
| SCHEMBL14397964 | 0.56 | MGAM (0.37) | — | |
| SCHEMBL5323960 | 0.54 | — | — | |
| SCHEMBL13790770 | 0.54 | — | — | |
| SCHEMBL10359517 | 0.54 | — | — | |
| SCHEMBL13943872 | 0.54 | — | — | |
| SCHEMBL18013298 | 0.53 | — | — | |
| SCHEMBL16942516 | 0.53 | DRD4 (0.37) | — |
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-5109006-A | Anorexogenic agents, analgesics, psychological disorders | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-04-28 | — | — | US | disclosed |