⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3900238 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL3904158 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL3901450 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL3900896 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL3912384 | 0.78 | — | — | |
| SCHEMBL3901452 | 0.77 | — | — | |
| SCHEMBL3898420 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL3898417 | 0.65 | — | — | |
| SCHEMBL4611989 | 0.61 | HDAC3 (0.33) | — | |
| SCHEMBL17859800 | 0.59 | ATM (0.42) | — |
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-1752462-B1 | Siloxy substituted metallocene catalysts | BOREALIS TECH OY (FI) | 2009-03-18 | — | — | EP | disclosed |
| EP-1752462-A1 | Siloxy substituted metallocene catalysts | Borealis Technology Oy (FI) | 2007-02-14 | — | — | EP | disclosed |