⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28529559 | 0.98 | — | — | |
| Methane SCHEMBL10320030 | 0.79 | — | — | |
| SCHEMBL4448996 | 0.76 | — | — | |
| SCHEMBL28132668 | 0.74 | — | — | |
| SCHEMBL28986382 | 0.73 | — | — | |
| SCHEMBL28951683 | 0.72 | — | — | |
| SCHEMBL4370009 | 0.70 | — | — | |
| SCHEMBL6859000 | 0.69 | — | — | |
| SCHEMBL27447163 | 0.69 | — | — | |
| SCHEMBL28534980 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0579460-A2 | Curable polyether composition | GENERAL ELECTRIC COMPANY (US) | 1994-01-19 | — | — | EP | disclosed |