⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30240774 | 0.89 | BID (0.31) | — | |
| SCHEMBL5655348 | 0.89 | BID (0.31) | — | |
| SCHEMBL4299220 | 0.86 | MEN1 (0.32) | — | |
| SCHEMBL6462737 | 0.83 | NAAA (0.32) | — | |
| SCHEMBL6467121 | 0.82 | ALDH1A1 (0.34) | — | |
| SCHEMBL1276666 | 0.81 | MEN1 (0.35) | — | |
| SCHEMBL5653811 | 0.81 | MEN1 (0.33) | — | |
| SCHEMBL5872296 | 0.81 | MEN1 (0.33) | — | |
| Dymanthine SCHEMBL1276492 | 0.81 | DNM1 (0.40) | — | |
| SCHEMBL5656345 | 0.81 | MEN1 (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7098356-B2 | Substituted indenyl metal complexes and polymerization process | DOW GLOBAL TECHNOLOGIES INC. (US) | 2006-08-29 | — | — | US | disclosed |
| US-6872844-B2 | Metal complexes containing acetylenic ligands, polymerization catalysts and addition polymerization process | THE DOW CHEMICAL COMPANY (US) | 2005-03-29 | — | — | US | disclosed |
| US-20020183464-A1 | 3-aryl-substituted cyclopentadienyl metal complexes and polymerization process | DOW GLOBAL TECHNOLOGIES LLC | 2002-12-05 | — | — | US | disclosed |