⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL384242 | 0.46 | — | — | |
| SCHEMBL25165651 | 0.45 | — | — | |
| SCHEMBL13255686 | 0.45 | — | — | |
| SCHEMBL289020 | 0.43 | — | — | |
| SCHEMBL19346764 | 0.43 | — | — | |
| SCHEMBL13121750 | 0.41 | — | — | |
| SCHEMBL1144503 | 0.41 | — | — | |
| SCHEMBL13121654 | 0.41 | — | — | |
| SCHEMBL261738 | 0.41 | — | — | |
| SCHEMBL191970 | 0.41 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020149400-A1 | THERMOPLASTIC ELASTOMER COMPOSITION, AND METHOD FOR PRODUCING THERMOPLASTIC ELASTOMER COMPOSITION | ＪＸＴＧエネルギー株式会社 | 2020-07-23 | — | — | WO | disclosed |