⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5395458 | 0.86 | — | — | |
| SCHEMBL7194998 | 0.76 | — | — | |
| SCHEMBL5390625 | 0.70 | — | — | |
| SCHEMBL5403013 | 0.69 | — | — | |
| SCHEMBL7188369 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL7637333 | 0.68 | — | — | |
| SCHEMBL7009427 | 0.67 | PDCD1 (0.34) | — | |
| SCHEMBL21778060 | 0.67 | PDCD1 (0.34) | — | |
| SCHEMBL27494089 | 0.67 | PDCD1 (0.34) | — | |
| SCHEMBL7637335 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7220695-B2 | Supported activator | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-05-22 | — | — | US | claimed |