⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18784103 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL27650199 | 0.64 | SCD (0.32) | — | |
| SCHEMBL27496651 | 0.61 | — | — | |
| SCHEMBL4663340 | 0.60 | SKP2 (0.31) | — | |
| SCHEMBL7648194 | 0.60 | SKP2 (0.31) | — | |
| SCHEMBL6432123 | 0.59 | — | — | |
| Hydrochloric Acid SCHEMBL2226146 | 0.58 | — | — | |
| Fluoride Ion SCHEMBL5147294 | 0.58 | — | — | |
| SCHEMBL8162783 | 0.57 | — | — | |
| SCHEMBL10447160 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1349653-A2 | FLUORINATED ZWITTERIONIC COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION | ExxonMobil Chemical Patents Inc. (US) | 2003-10-08 | — | — | EP | disclosed |
| WO-2002036639-A2 | FLUORINATED ZWITTERIONIC COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2002-05-10 | — | — | WO | disclosed |