⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28477262 | 0.90 | — | — | |
| SCHEMBL842545 | 0.85 | — | — | |
| Piperazine SCHEMBL28399383 | 0.84 | HIF1A (0.30) | — | |
| SCHEMBL6280788 | 0.80 | TSHR (0.35) | — | |
| Piperazine SCHEMBL28392496 | 0.78 | HIF1A (0.30) | — | |
| SCHEMBL27512819 | 0.76 | — | — | |
| SCHEMBL28665588 | 0.73 | TSHR (0.35) | — | |
| SCHEMBL38654149 | 0.73 | TSHR (0.35) | — | |
| SCHEMBL27878153 | 0.72 | — | — | |
| SCHEMBL28658915 | 0.71 | TSHR (0.39) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113754802-A | Catalyst system for olefin polymerization reaction and prepolymerization catalyst composition | 中国石油化工股份有限公司 | 2021-12-07 | — | — | CN | disclosed |
| US-20090043064-A1 | METAL COMPLEX, POLYMER COMPOUND, AND DEVICE CONTAINING IT | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-02-12 | — | — | US | disclosed |
| US-6919291-B2 | Fluorinated zwitterionic cocatalyst activators for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2005-07-19 | — | — | US | disclosed |
| US-20040110631-A1 | Fluorinated zwitterionic cocatalyst activators for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. | 2004-06-10 | — | — | US | disclosed |
| 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 |