⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9813797 | 1.00 | — | — | |
| SCHEMBL21967087 | 0.75 | — | — | |
| SCHEMBL21967085 | 0.75 | — | — | |
| SCHEMBL1415519 | 0.72 | — | — | |
| SCHEMBL11649990 | 0.72 | — | — | |
| SCHEMBL11649987 | 0.72 | — | — | |
| SCHEMBL5830951 | 0.72 | — | — | |
| SCHEMBL5696389 | 0.71 | — | — | |
| SCHEMBL1679775 | 0.71 | — | — | |
| SCHEMBL3989087 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0232851-B1 | POLYSACCARIDE DERIVATIVES CONTAINING ALDEHYDE GROUPS, CORRESPONDING ACETALS AND USE AS PAPER ADDITIVES | National Starch and Chemical Investment Holding Corporation (US) | 1991-07-31 | — | — | EP | disclosed |
| EP-0232851-A2 | Polysaccaride derivatives containing aldehyde groups, corresponding acetals and use as paper additives | National Starch and Chemical Investment Holding Corporation (US) | 1987-08-19 | — | — | EP | disclosed |
| US-4087465-A | Process for the preparation of halogeno-acetals from enoxysilanes | RHONE-POULENC INDUSTRIES (FR) | 1978-05-02 | — | — | US | disclosed |