⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10543060 | 1.00 | — | — | |
| SCHEMBL4601760 | 0.92 | TSHR (0.35) | — | |
| SCHEMBL5000901 | 0.90 | TSHR (0.40) | — | |
| SCHEMBL6713942 | 0.89 | TSHR (0.39) | — | |
| SCHEMBL26086841 | 0.89 | TSHR (0.39) | — | |
| SCHEMBL6713936 | 0.89 | TSHR (0.39) | — | |
| SCHEMBL18037103 | 0.84 | TSHR (0.44) | — | |
| SCHEMBL29284281 | 0.84 | TSHR (0.44) | — | |
| SCHEMBL18037105 | 0.84 | TSHR (0.44) | — | |
| SCHEMBL11227907 | 0.84 | TSHR (0.44) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118139909-A | Beta-methyl-delta-valerolactone based polymer | 株式会社可乐丽 | 2024-06-04 | — | — | CN | disclosed |
| CN-118139926-A | Resin composition | 株式会社可乐丽 | 2024-06-04 | — | — | CN | disclosed |
| WO-2023068346-A1 | Β-METHYL-δ-VALEROLACTONE POLYMER | 株式会社クラレ | 2023-04-27 | — | — | WO | disclosed |
| WO-2023068345-A1 | Β-METHYL-δ-VALEROLACTONE POLYMER | 株式会社クラレ | 2023-04-27 | — | — | WO | disclosed |
| WO-2023068348-A1 | RESIN COMPOSITION | 株式会社クラレ | 2023-04-27 | — | — | WO | disclosed |