⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7603368 | 0.84 | — | — | |
| SCHEMBL797227 | 0.81 | — | — | |
| SCHEMBL7602820 | 0.76 | GABRA1 (0.30) | — | |
| SCHEMBL7598696 | 0.72 | — | — | |
| SCHEMBL8506274 | 0.71 | GABRA1 (0.35) | — | |
| SCHEMBL797476 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL5583459 | 0.70 | GABRA1 (0.34) | — | |
| SCHEMBL28407141 | 0.68 | GABRA1 (0.35) | — | |
| SCHEMBL5860017 | 0.68 | GABRA1 (0.35) | — | |
| SCHEMBL27506824 | 0.68 | GABRA1 (0.35) | — |
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 |