⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28219694 | 0.79 | CYP1A2 (0.36) | — | |
| SCHEMBL6294392 | 0.78 | — | — | |
| SCHEMBL8160478 | 0.78 | — | — | |
| SCHEMBL7159928 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL8160475 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL6294390 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL6833271 | 0.77 | — | — | |
| SCHEMBL6062595 | 0.73 | — | — | |
| SCHEMBL7159359 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL6830690 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6746981-B2 | OLEFIN POLYMERIZATION CATALYSTS WITH PRODUCTIVITY WHEN FRESH OF >/= 18,000 GRAMS OF POLYETHYLENE PER GRAM OF CATALYST IN ONE HOUR, AND A SPECIFIC SURFACE AREA OF </= 20 M2/G | ALBEMARLE CORPORATION | 2004-06-08 | — | — | US | disclosed |
| US-20030105253-A1 | Particulate group 4 metallocene-aluminoxane catalyst compositions devoid of preformed support, and their preparation and their use | ALBEMARLE CORPORATION | 2003-06-05 | — | — | US | disclosed |
| US-6521728-B1 | Particulate group 4 metallocene-aluminoxane catalyst compositions devoid of preformed support, and their preparation and their use | ALBEMARLE CORPORATION | 2003-02-18 | — | — | US | disclosed |