⚠ 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 SCHEMBL15815172 | 0.99 | — | — | |
| SCHEMBL20814919 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL15814944 | 0.90 | — | — | |
| SCHEMBL18769880 | 0.90 | — | — | |
| SCHEMBL29745798 | 0.90 | — | — | |
| SCHEMBL20814849 | 0.89 | BRD4 (0.30) | — | |
| SCHEMBL20814794 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL15815080 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL15815216 | 0.89 | BRD4 (0.30) | — | |
| Hydrochloric Acid SCHEMBL15815048 | 0.89 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2935297-B1 | BRIDGED METALLOCENE COMPOUNDS, CATALYST SYSTEMS AND PROCESSES FOR POLYMERIZATION THEREWITH | EXXONMOBIL CHEMICAL PATENTS INC (US) | 2019-03-20 | — | — | EP | claimed |