⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL261785 | 0.82 | — | — | |
| SCHEMBL18499412 | 0.82 | — | — | |
| SCHEMBL1403976 | 0.75 | — | — | |
| SCHEMBL14394010 | 0.75 | — | — | |
| SCHEMBL823130 | 0.70 | — | — | |
| SCHEMBL261789 | 0.68 | — | — | |
| SCHEMBL12511063 | 0.68 | — | — | |
| SCHEMBL12087107 | 0.68 | — | — | |
| SCHEMBL2526925 | 0.67 | — | — | |
| SCHEMBL11050924 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4438277-A | Hydronaphthalene derivatives | SANKYO COMPANY, LIMITED (JP) | 1984-03-20 | — | — | US | disclosed |
| US-4361515-A | Antihyperlipemic dihydro-ML-236B derivatives, their preparation and use | SANKYO COMPANY, LIMITED (JP) | 1982-11-30 | — | — | US | disclosed |