⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8902513 | 0.79 | — | — | |
| SCHEMBL11051500 | 0.76 | MAPT (0.33) | — | |
| Hydrochloric Acid SCHEMBL28937661 | 0.70 | — | — | |
| SCHEMBL28840575 | 0.65 | — | — | |
| SCHEMBL4071727 | 0.65 | — | — | |
| SCHEMBL28933250 | 0.63 | MAOB (0.30) | — | |
| SCHEMBL10788523 | 0.61 | — | — | |
| SCHEMBL28417606 | 0.60 | — | — | |
| SCHEMBL28644205 | 0.58 | — | — | |
| Sulfuric Acid SCHEMBL29003544 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1414791-A1 | METHOD FOR THE PRODUCTION OF 1,2,4-TRIAMINOBENZOLECARBAMIC ACID ESTERS | VIATRIS GmbH & Co. KG (DE) | 2004-05-06 | — | — | EP | disclosed |
| WO-2003010134-A1 | METHOD FOR THE PRODUCTION OF 1,2,4-TRIAMINOBENZOLECARBAMIC ACID ESTERS | VIATRIS GMBH & CO. KG (DE) | 2003-02-06 | — | — | WO | disclosed |