⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9051400 | 0.84 | — | — | |
| SCHEMBL5892554 | 0.69 | — | — | |
| SCHEMBL18898876 | 0.67 | TSHR (0.30) | — | |
| SCHEMBL23169061 | 0.67 | — | — | |
| SCHEMBL16589344 | 0.67 | TSHR (0.41) | — | |
| SCHEMBL1921235 | 0.67 | — | — | |
| SCHEMBL17305279 | 0.67 | PIK3CD (0.37) | — | |
| SCHEMBL5892337 | 0.64 | — | — | |
| SCHEMBL12659745 | 0.63 | ALDH1A1 (0.32) | — | |
| SCHEMBL23917334 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-8143618-A | — | — | None | — | — | JP | disclosed |
| JP-H08143618-A | PRODUCING OF CATALYST FOR COPOLYMERIZATION OF ETHYLENE AND ETHYLENE COPOLYMER | SHOWA DENKO KK | 1996-06-04 | — | — | JP | disclosed |