⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL576072 | 0.73 | — | — | |
| SCHEMBL7965328 | 0.73 | — | — | |
| SCHEMBL7961466 | 0.73 | — | — | |
| SCHEMBL7961468 | 0.73 | — | — | |
| SCHEMBL16899656 | 0.73 | CYP3A4 (0.31) | — | |
| Ammonia Solution, Strong SCHEMBL7240809 | 0.71 | — | — | |
| SCHEMBL17379298 | 0.69 | — | — | |
| SCHEMBL17379262 | 0.69 | — | — | |
| SCHEMBL7967596 | 0.69 | — | — | |
| SCHEMBL23554196 | 0.69 | TSHR (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160333277-A1 | METHOD FOR REMOVING SULFUR COMPOUNDS FROM HYDROCARBON STREAMS | BASF SE (DE) | 2016-11-17 | — | — | US | disclosed |
| EP-3092288-A1 | METHOD FOR REMOVING SULFUR COMPOUNDS FROM HYDROCARBON STREAMS | BASF SE (DE) | 2016-11-16 | — | — | EP | disclosed |
| WO-2015104304-A1 | METHOD FOR REMOVING SULFUR COMPOUNDS FROM HYDROCARBON STREAMS | BASF SE (DE) | 2015-07-16 | — | — | WO | disclosed |