⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13364998 | 0.84 | ALDH1A1 (0.31) | — | |
| SCHEMBL16659169 | 0.83 | CYP3A4 (0.30) | — | |
| SCHEMBL87294 | 0.76 | — | — | |
| SCHEMBL16899616 | 0.75 | — | — | |
| SCHEMBL16899660 | 0.73 | — | — | |
| SCHEMBL15892716 | 0.71 | — | — | |
| SCHEMBL31287571 | 0.69 | — | — | |
| SCHEMBL8757221 | 0.67 | — | — | |
| SCHEMBL10976583 | 0.65 | — | — | |
| SCHEMBL28836199 | 0.65 | — | — |
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-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 |
| CN-106103665-A | Process for removing sulfur compounds from a hydrocarbon-containing stream | 巴斯夫欧洲公司 | 2016-11-09 | — | — | CN | disclosed |
| WO-2015104304-A1 | METHOD FOR REMOVING SULFUR COMPOUNDS FROM HYDROCARBON STREAMS | BASF SE (DE) | 2015-07-16 | — | — | WO | disclosed |