⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21799 | 0.96 | — | — | |
| SCHEMBL11248428 | 0.92 | — | — | |
| Dichloropropane SCHEMBL10744698 | 0.89 | LMNA (0.32) | — | |
| Aluminum Chloride Anhydrous SCHEMBL27946521 | 0.86 | TSHR (0.30) | — | |
| SCHEMBL11821977 | 0.81 | — | — | |
| SCHEMBL29008802 | 0.81 | TSHR (0.47) | — | |
| Methane SCHEMBL28069037 | 0.76 | — | — | |
| Fluoride SCHEMBL28060200 | 0.76 | — | — | |
| SCHEMBL28802451 | 0.74 | TSHR (0.55) | — | |
| SCHEMBL445537 | 0.74 | — | — |
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-1012615-B | POLYMARIZATION METHOD FOR PRODCING POLYACRYLATES | POLYMER TECHNOLOGY INC (US) | 1991-05-15 | — | — | CN | disclosed |
| CN-1040801-A | Polymarization method for prodcing polyacrylates | POLYMER TECHNOLOGY INC (US) | 1990-03-28 | — | — | CN | disclosed |