⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5492965 | 0.77 | — | — | |
| SCHEMBL236054 | 0.77 | — | — | |
| SCHEMBL4298319 | 0.70 | THRB (0.37) | — | |
| SCHEMBL377364 | 0.69 | — | — | |
| SCHEMBL28350540 | 0.69 | ADRB2 (0.47) | — | |
| SCHEMBL3967101 | 0.68 | THRB (0.42) | — | |
| SCHEMBL9238208 | 0.68 | THRB (0.42) | — | |
| Hydrochloric Acid SCHEMBL9876536 | 0.68 | ADRB2 (0.41) | — | |
| Hydrochloric Acid SCHEMBL9420404 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL236055 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1232193-B1 | CATALYST FOR THE POLYMERIZATION OF OLEFINS | BASELL POLIOLEFINE SRL (IT) | 2007-02-07 | — | — | EP | claimed |
| EP-1232193-A1 | CATALYST FOR THE POLYMERIZATION OF OLEFINS | Basell Technology Company B.V. (NL) | 2002-08-21 | — | — | EP | claimed |
| WO-2001019879-A1 | CATALYST FOR THE POLYMERIZATION OF OLEFINS | BASELL TECHNOLOGY COMPANY B.V. (NL) | 2001-03-22 | — | — | WO | claimed |