⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7048988 | 0.85 | GABRA1 (0.33) | — | |
| SCHEMBL7807233 | 0.78 | GABRA1 (0.36) | — | |
| SCHEMBL7050764 | 0.78 | — | — | |
| SCHEMBL7597790 | 0.77 | GABRA1 (0.35) | — | |
| SCHEMBL5351499 | 0.75 | — | — | |
| SCHEMBL4082379 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL6523675 | 0.73 | — | — | |
| SCHEMBL7048429 | 0.70 | — | — | |
| SCHEMBL27550028 | 0.69 | GABRA1 (0.38) | — | |
| SCHEMBL27464415 | 0.69 | GABRA1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1058694-B1 | Catalyst system, method for its production and its use for the polymerisation of olefins | BASELL POLYOLEFINE GMBH (DE) | 2003-04-09 | — | — | EP | claimed |
| US-6524988-B2 | Metallocene, an activator and a fluorided support; polymerization catalyst | EXXONMOBIL CHEMICAL PATENTS INC. | 2003-02-25 | — | — | US | disclosed |
| US-20010051698-A1 | Highly active supported catalyst compositions | EXXONMOBIL CHEMICAL PATENTS INC. | 2001-12-13 | — | — | US | disclosed |