⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6048139 | 0.75 | — | — | |
| SCHEMBL12746438 | 0.71 | — | — | |
| SCHEMBL26738654 | 0.69 | FDPS (0.41) | — | |
| SCHEMBL23683867 | 0.67 | FDPS (0.35) | — | |
| SCHEMBL6048135 | 0.65 | FDPS (0.35) | — | |
| SCHEMBL1400750 | 0.65 | — | — | |
| SCHEMBL13957505 | 0.65 | NFKB1 (0.40) | — | |
| SCHEMBL6041029 | 0.64 | — | — | |
| SCHEMBL1412677 | 0.62 | NFKB1 (0.47) | — | |
| SCHEMBL11995817 | 0.62 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1632253-A1 | Material for odour control | BKI Holding Corporation (US) | 2006-03-08 | — | — | EP | disclosed |
| US-20060029567-A1 | Material for odor control | BKI HOLDING CORPORATION (US) | 2006-02-09 | — | — | US | disclosed |
| EP-0119487-B1 | NOVEL N-ALIPHATIC AND N,N-ALIPHATIC PHOSPHORIC TRIAMIDE UREASE INHIBITORS AND UREASE INHIBITED UREA BASED FERTILIZER COMPOSITIONS | ALLIED CORPORATION (US) | 1986-07-16 | — | — | EP | disclosed |
| US-4530714-A | Capable of forming urea under use conditions | ALLIED CORPORATION (US) | 1985-07-23 | — | — | US | disclosed |
| EP-0119487-A1 | Novel N-aliphatic and N,N-aliphatic phosphoric triamide urease inhibitors and urease inhibited urea based fertilizer compositions | ALLIED CORPORATION (US) | 1984-09-26 | — | — | EP | disclosed |