⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL439331 | 0.76 | — | — | |
| SCHEMBL4397708 | 0.74 | — | — | |
| SCHEMBL7670774 | 0.72 | — | — | |
| SCHEMBL1115944 | 0.72 | — | — | |
| SCHEMBL8462465 | 0.72 | — | — | |
| SCHEMBL17049053 | 0.72 | — | — | |
| SCHEMBL59400 | 0.69 | — | — | |
| SCHEMBL353598 | 0.69 | — | — | |
| SCHEMBL17048775 | 0.68 | DNM1 (0.33) | — | |
| Propane SCHEMBL7854262 | 0.67 | HSD17B10 (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021049589-A1 | CURABLE COMPOSITION, TWO-LIQUID CURABLE COMPOSITION SET, AND METHOD FOR PRODUCING BONDED ARTICLE | 東亞合成株式会社 | 2021-03-18 | — | — | WO | disclosed |
| WO-2020085334-A1 | PHOTOCURABLE ADHESIVE COMPOSITION | 東亞合成株式会社 | 2020-04-30 | — | — | WO | disclosed |
| WO-2020085335-A1 | PRODUCTION METHOD FOR 2-CYANOACRYLATE COMPOUND AND PRODUCTION METHOD FOR PHOTOCURABLE ADHESIVE COMPOSITION | 東亞合成株式会社 | 2020-04-30 | — | — | WO | disclosed |