⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11883295 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL38651990 | 0.72 | ALDH1A1 (0.34) | — | |
| SCHEMBL10786844 | 0.65 | ALDH1A1 (0.38) | — | |
| SCHEMBL1270515 | 0.62 | — | — | |
| SCHEMBL9502432 | 0.62 | ALDH1A1 (0.31) | — | |
| SCHEMBL423317 | 0.61 | ALDH1A1 (0.39) | — | |
| SCHEMBL176493 | 0.60 | — | — | |
| SCHEMBL3433861 | 0.60 | — | — | |
| SCHEMBL11030655 | 0.60 | — | — | |
| Phosphoric Acid SCHEMBL29092860 | 0.60 | ALDH1A1 (0.42) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1986981-B1 | PREPARATIONS WITH IMPROVED UREASE-INHIBITING PROPERTIES AND THOSE PREPARATIONS CONTAINING UREA BASED FERTILIZERS. | BASF SE (DE) | 2018-08-08 | — | — | EP | claimed |
| EP-1986981-A1 | PREPARATIONS WITH IMPROVED UREASE-INHIBITING EFFECT AND UREA-CONTAINING FERTILIZERS CONTAINING THE LATTER | BASF SE (DE) | 2008-11-05 | — | — | EP | claimed |
| WO-2007093528-A1 | PREPARATIONS WITH IMPROVED UREASE-INHIBITING EFFECT AND UREA-CONTAINING FERTILIZERS CONTAINING THE LATTER | BASF SE (DE) | 2007-08-23 | — | — | WO | claimed |
| EP-1820788-A1 | Preparations with improved urease-inhibiting properties and those preparations containing urea based fertilizers. | BASF Aktiengesellschaft (DE) | 2007-08-22 | — | — | EP | claimed |