⚠ 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 SCHEMBL2363445 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL6462776 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL6533622 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL6462946 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL273030 | 0.61 | — | — | |
| SCHEMBL7552837 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL7102879 | 0.58 | — | — | |
| SCHEMBL251872 | 0.56 | — | — | |
| SCHEMBL6812157 | 0.56 | — | — | |
| SCHEMBL525718 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268575-B1 | NITROGEN-CONTAINING GROUP-13 ANIONIC COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEM PATENTS INC (US) | 2004-06-09 | — | — | EP | disclosed |
| US-20030083515-A1 | Nitrogen-containing group-13 anionic compounds for olefin polymerization | RODRIGUEZ GEORGE (US) | 2003-05-01 | — | — | US | disclosed |
| EP-1268575-A2 | NITROGEN-CONTAINING GROUP-13 ANIONIC COMPOUNDS FOR OLEFIN POLYMERIZATION | ExxonMobil Chemical Patents Inc. (US) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001081435-A2 | NITROGEN-CONTAINING GROUP-13 ANIONIC COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS, INC. (US) | 2001-11-01 | — | — | WO | disclosed |