⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9615101 | 0.58 | — | — | |
| Iodide SCHEMBL1686563 | 0.58 | — | — | |
| SCHEMBL3867733 | 0.58 | — | — | |
| SCHEMBL968846 | 0.58 | — | — | |
| Water SCHEMBL10375906 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL154308 | 0.58 | — | — | |
| Fluoride Ion SCHEMBL150863 | 0.58 | — | — | |
| SCHEMBL311348 | 0.58 | — | — | |
| SCHEMBL5383540 | 0.58 | — | — | |
| SCHEMBL27278502 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0954540-B1 | A PROCESS FOR POLYMERIZING OLEFINS | SABIC POLYPROPYLENES BV (NL) | 2004-07-28 | — | — | EP | disclosed |
| US-6218487-B1 | AS COCATALYST A HALOHYDROCARBYL SILANE, GERMANE, STANNANE OR PLUMBANE | DSM N.V. (NL) | 2001-04-17 | — | — | US | disclosed |