⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5082803 | 0.92 | — | — | |
| SCHEMBL19056240 | 0.91 | — | — | |
| SCHEMBL19056295 | 0.85 | — | — | |
| SCHEMBL16339194 | 0.85 | — | — | |
| SCHEMBL5079290 | 0.81 | — | — | |
| SCHEMBL3677685 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL1141262 | 0.79 | HTR1A (0.30) | — | |
| SCHEMBL19056292 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL6679040 | 0.78 | — | — | |
| SCHEMBL9286135 | 0.78 | — | — |
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-1964860-B1 | ETHYLENE POLYMER, CATALYST FOR PRODUCTION OF ETHYLENE POLYMER, AND PROCESS FOR PRODUCTION OF ETHYLENE POLYMER | TOSOH CORP (JP) | 2017-07-05 | — | — | EP | disclosed |