⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8743274 | 0.76 | MEN1 (0.40) | — | |
| SCHEMBL14321383 | 0.76 | MEN1 (0.33) | — | |
| SCHEMBL18089129 | 0.74 | — | — | |
| SCHEMBL245413 | 0.74 | — | — | |
| SCHEMBL19417872 | 0.74 | — | — | |
| SCHEMBL12153382 | 0.74 | MEN1 (0.50) | — | |
| SCHEMBL18089132 | 0.74 | — | — | |
| SCHEMBL2959769 | 0.74 | MEN1 (0.46) | — | |
| SCHEMBL245412 | 0.73 | — | — | |
| SCHEMBL20696042 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180346825-A1 | COMPOSITION OF SEQUESTRANT FOR APPLICATION TO THE ELIMINATION AND/OR REDUCTION OF HYDROGEN SULFIDE AND/OR MERCAPTANS IN FLUID | OXITENO S.A. INDÚSTRIA E COMÉRCIO (BR) | 2018-12-06 | — | — | US | claimed |
| US-20180346825-A1 | COMPOSITION OF SEQUESTRANT FOR APPLICATION TO THE ELIMINATION AND/OR REDUCTION OF HYDROGEN SULFIDE AND/OR MERCAPTANS IN FLUID | OXITENO S.A. INDÚSTRIA E COMÉRCIO (BR) | 2018-12-06 | — | — | US | disclosed |
| EP-0230475-B1 | NOVEL UREA DERIVATIVES, PROCESSES FOR PRODUCTION THEREOF AND HERBICIDE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1992-03-18 | — | — | EP | disclosed |
| US-4838924-A | NONPHYTOTOXIC | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1989-06-13 | — | — | US | disclosed |