⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18112595 | 0.78 | TSHR (0.33) | — | |
| SCHEMBL21784052 | 0.77 | — | — | |
| SCHEMBL26091683 | 0.77 | — | — | |
| SCHEMBL26091679 | 0.77 | — | — | |
| SCHEMBL18924093 | 0.77 | — | — | |
| SCHEMBL29818225 | 0.75 | — | — | |
| SCHEMBL24629606 | 0.74 | — | — | |
| SCHEMBL13719254 | 0.74 | — | — | |
| SCHEMBL9070332 | 0.74 | TSHR (0.39) | — | |
| SCHEMBL5934985 | 0.72 | — | — |
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-111868945-B | Method for applying at least one silicone layer by laser transfer printing | 瓦克化学股份公司 | 2023-08-11 | — | — | CN | disclosed |
| WO-2000020509-A1 | SPORTING GOOD MADE FROM POLYCARBONATE MIXTURES | BASF AKTIENGESELLSCHAFT (DE) | 2000-04-13 | — | — | WO | disclosed |