⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7938792 | 0.96 | — | — | |
| Iodide SCHEMBL27948701 | 0.96 | — | — | |
| Bromide SCHEMBL27948659 | 0.96 | — | — | |
| Fluoride Ion SCHEMBL5167038 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL1670651 | 0.83 | — | — | |
| Bromide SCHEMBL27932911 | 0.83 | — | — | |
| Iodide SCHEMBL27932971 | 0.83 | — | — | |
| Fluoride Ion SCHEMBL27948951 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL27855360 | 0.80 | ACHE (0.33) | — | |
| Fluoride Ion SCHEMBL6059129 | 0.79 | — | — |
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-1915402-A1 | SUPPORTED METALLOCENE-ALKYL CATALYST COMPOSITION | Univation Technologies, LLC (US) | 2008-04-30 | — | — | EP | disclosed |
| WO-2007015764-A1 | SUPPORTED METALLOCENE-ALKYL CATALYST COMPOSITION | UNIVATION TECHNOLOGIES, LLC (US) | 2007-02-08 | — | — | WO | disclosed |