⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9070774 | 0.80 | — | — | |
| SCHEMBL20663535 | 0.79 | — | — | |
| SCHEMBL869711 | 0.79 | — | — | |
| SCHEMBL19733683 | 0.79 | — | — | |
| SCHEMBL10272347 | 0.79 | — | — | |
| SCHEMBL12904871 | 0.79 | — | — | |
| SCHEMBL6468279 | 0.73 | — | — | |
| SCHEMBL637507 | 0.73 | — | — | |
| SCHEMBL24235770 | 0.73 | — | — | |
| SCHEMBL4665164 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022179864-A1 | PROCESS FOR THE PRODUCTION OF POLYALKYLENE-POLYAMINES BY CONDENSATION OF ALKYLENE-DIAMINES | BASF SE (DE) | 2022-09-01 | — | — | WO | disclosed |
| CN-113544114-A | Preparation of polyalkylene polyamines by reductive amination | 巴斯夫欧洲公司 | 2021-10-22 | — | — | CN | disclosed |