⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1473747 | 0.78 | SLC1A3 (0.31) | — | |
| SCHEMBL7998263 | 0.70 | HSD11B1 (0.33) | — | |
| SCHEMBL9067263 | 0.65 | — | — | |
| SCHEMBL17626918 | 0.65 | — | — | |
| SCHEMBL7700840 | 0.64 | MAPT (0.33) | — | |
| SCHEMBL3154657 | 0.63 | POLB (0.32) | — | |
| SCHEMBL8401949 | 0.61 | CYP2C19 (0.37) | — | |
| Bicarbonate SCHEMBL3257312 | 0.59 | — | — | |
| SCHEMBL178371 | 0.57 | CYP2C19 (0.54) | — | |
| SCHEMBL15237486 | 0.57 | CYP2C19 (0.54) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105008971-B | Photocurable adhesive, and polarizing plate, laminated optical member, and liquid crystal display device using same | 住友化学株式会社 | 2017-07-28 | — | — | CN | disclosed |
| EP-0198498-B1 | BLENDS OF POLYCAPROLACTONE POLYOLS AND POLYEPOXIDES | UNION CARBIDE CORPORATION (US) | 1990-10-24 | — | — | EP | disclosed |
| EP-0198498-A2 | Blends of polycaprolactone polyols and polyepoxides | UNION CARBIDE CORPORATION (US) | 1986-10-22 | — | — | EP | disclosed |
| US-4045474-A | COATINGS | UNION CARBIDE CORPORATION (US) | 1977-08-30 | — | — | US | disclosed |
| US-4043969-A | Casting compound for semiconductor devices | NATIONAL SEMICONDUCTOR CORPORATION (US) | 1977-08-23 | — | — | US | disclosed |
| US-3954650-A | Amine hardner compositions | UNION CARBIDE CORPORATION (US) | 1976-05-04 | — | — | US | disclosed |