⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL797264 | 0.85 | — | — | |
| SCHEMBL797247 | 0.75 | — | — | |
| SCHEMBL4622292 | 0.74 | — | — | |
| SCHEMBL7601474 | 0.69 | GABRA1 (0.35) | — | |
| SCHEMBL7602956 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL3686918 | 0.68 | GABRA1 (0.31) | — | |
| SCHEMBL796834 | 0.67 | — | — | |
| SCHEMBL7599538 | 0.67 | ROCK2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL4295268 | 0.67 | GABRA1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL7939922 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | claimed |
| US-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | disclosed |