⚠ 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 | |
|---|---|---|---|---|
| Dimethylamine SCHEMBL28098217 | 1.00 | ALDH1A1 (0.56) | — | |
| Dimethylamine SCHEMBL9854037 | 1.00 | ALDH1A1 (0.56) | — | |
| Dimethylamine SCHEMBL10821635 | 0.94 | — | — | |
| Dimethylamine SCHEMBL27962927 | 0.94 | — | — | |
| Chloroform SCHEMBL3237209 | 0.88 | — | — | |
| Dimethylamine SCHEMBL2552757 | 0.85 | — | — | |
| Isobutane SCHEMBL9743529 | 0.80 | — | — | |
| SCHEMBL2556849 | 0.79 | — | — | |
| SCHEMBL7725 | 0.79 | — | — | |
| Dimethylamine SCHEMBL22190253 | 0.78 | — | — |
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-3342903-B1 | PREPARATION METHOD FOR GRAPHENE-POLYAMIDE NANO-COMPOSITE FIBER | NANTONG QIANGSHENG GRAPHENE TECH CO LTD (CN) | 2020-09-09 | — | — | EP | claimed |
| US-6193843-B1 | PREPARED BY REACTING A POLYSACCHARIDE WITH A POLYCATIONIC REAGENT HAVING ONE POLYSACCHARIDE REACTIVE GROUP AND AT LEAST TWO CATIONIC GROUPS; SUITABLE REAGENTS INCLUDE POLYCATIONIC ALKYL, ARYL, ALKARYL, CYCLOALIPHATIC, OR HETEROCYCLIC AMINES | NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION | 2001-02-27 | — | — | US | disclosed |
| EP-0406837-A2 | Cationic polysaccharides and reagents for their preparation | National Starch and Chemical Investment Holding Corporation (US) | 1991-01-09 | — | — | EP | disclosed |