⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25272517 | 0.94 | PRKD3 (0.31) | — | |
| SCHEMBL25272834 | 0.92 | PRKD3 (0.33) | — | |
| SCHEMBL25228682 | 0.92 | PRKD3 (0.33) | — | |
| SCHEMBL25224624 | 0.92 | PRKD3 (0.33) | — | |
| SCHEMBL25228189 | 0.92 | PRKD3 (0.33) | — | |
| SCHEMBL25278220 | 0.92 | PRKD3 (0.33) | — | |
| SCHEMBL28656467 | 0.88 | — | — | |
| SCHEMBL16497587 | 0.85 | — | — | |
| SCHEMBL7909531 | 0.84 | — | — | |
| SCHEMBL16496858 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109715680-B | Process for preparing high cis-1, 4-polydienes with lanthanide-based catalyst compositions | 株式会社普利司通 | 2021-10-19 | — | — | CN | disclosed |
| CN-106010382-B | Optical laminate and liquid crystal display device | 住友化学株式会社 | 2020-03-27 | — | — | CN | disclosed |