⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1401773 | 0.77 | — | — | |
| SCHEMBL4145490 | 0.76 | — | — | |
| SCHEMBL5200306 | 0.75 | — | — | |
| SCHEMBL16367777 | 0.74 | — | — | |
| SCHEMBL10455672 | 0.72 | — | — | |
| SCHEMBL17407452 | 0.72 | — | — | |
| SCHEMBL3218836 | 0.71 | — | — | |
| SCHEMBL11429502 | 0.71 | — | — | |
| SCHEMBL12368052 | 0.71 | — | — | |
| SCHEMBL8420239 | 0.71 | — | — |
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-5474657-A | In an electrolytic cell | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-12-12 | — | — | US | disclosed |