⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7629826 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL6904265 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL272043 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL816513 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL28960117 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL8727916 | 0.62 | — | — | |
| SCHEMBL8156354 | 0.61 | — | — | |
| SCHEMBL216721 | 0.61 | — | — | |
| SCHEMBL6254442 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL3962978 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011074688-A1 | PRODUCTION PROCESS OF OLEFIN POLYMERIZATION CATALYST AND OLEFIN POLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-06-23 | — | — | WO | disclosed |