⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL192270 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL6435423 | 0.88 | — | — | |
| Methylamine SCHEMBL3468040 | 0.72 | — | — | |
| Methylamine SCHEMBL2821987 | 0.72 | — | — | |
| Metam SCHEMBL6742856 | 0.69 | — | — | |
| SCHEMBL10181 | 0.67 | — | — | |
| SCHEMBL9157890 | 0.67 | LMNA (0.50) | — | |
| SCHEMBL253205 | 0.67 | — | — | |
| SCHEMBL10299728 | 0.67 | — | — | |
| SCHEMBL15192626 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6693191-B2 | FORMING NARROW PARTICLE SIZE LOW FINE CONTENT MATERIAL; REACTING METHYLAMMONIUM N-METHYLDITHIOCARBAMATE AND FORMALDEHYDE IN AQUEOUS SOLUTION WHILE MAINTAINING CONSTANT CONCENTRATION RATIO | BASF AKTIENGESELLSCHAFT (DE) | 2004-02-17 | — | — | US | disclosed |
| US-20030176692-A1 | Combining aqueous methylammonium N-methyldithiocarbamate with formaldehyde, separating then drying | BASF AKTIENGESELLSCHAFT (DE) | 2003-09-18 | — | — | US | disclosed |