⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7189473 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL648213 | 0.97 | — | — | |
| SCHEMBL5839707 | 0.97 | — | — | |
| Biphenyl SCHEMBL7194862 | 0.89 | — | — | |
| SCHEMBL8661615 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL647406 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL6755909 | 0.75 | — | — | |
| SCHEMBL7180986 | 0.74 | — | — | |
| Methane SCHEMBL5838941 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL7182345 | 0.73 | — | — |
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-20020052536-A1 | Hydrozirconated matrix and process for polyolefin production | ROHM AND HAAS COMPANY | 2002-05-02 | — | — | US | claimed |
| US-7074736-B2 | Hydrozirconated matrix and process for polyolefin production | ROHM AND HAAS COMPANY (US) | 2006-07-11 | — | — | US | disclosed |
| US-20020052536-A1 | Hydrozirconated matrix and process for polyolefin production | ROHM AND HAAS COMPANY | 2002-05-02 | — | — | US | disclosed |