Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7631635 | 0.94 | — | — | |
| SCHEMBL103619 | 0.94 | ALDH1A1 (0.30) | — | |
| SCHEMBL122904 | 0.94 | — | — | |
| SCHEMBL7937470 | 0.89 | — | — | |
| SCHEMBL17923452 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL8368817 | 0.88 | — | — | |
| SCHEMBL2995241 | 0.88 | — | — | |
| Iodide SCHEMBL7129349 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL6280773 | 0.88 | — | — | |
| SCHEMBL6513777 | 0.88 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6444605-B1 | REACTING A REACTION PRODUCT OF A MAGNESIUM ALKOXIDE OR ARYLOXIDE AND A GROUP IVB METAL ALKOXIDE OR ARYLOXIDE; AND A CYCLIC OR POLYCYCLIC HYDROCARBON; PREPARING POLYOLEFINS WITH BROAD OR BIMODAL MOLECULAR WEIGHT DISTRIBUTION | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION | 2002-09-03 | — | — | US | disclosed |
| US-6399531-B1 | COORDINATION CATALYST | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION | 2002-06-04 | — | — | US | disclosed |
| WO-2001048037-A1 | MIXED METAL ALKOXIDE AND CYCLOALKADIENYL CATALYSTS FOR THE PRODUCTION OF POLYOLEFINS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 2001-07-05 | — | — | WO | disclosed |
| WO-2001048038-A1 | HYBRID ZIEGLER-NATTA AND CYCLOALKADIENYL CATALYSTS FOR THE PRODUCTION OF POLYOLEFINS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 2001-07-05 | — | — | WO | disclosed |