⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1138513 | 0.82 | TSHR (0.31) | — | |
| SCHEMBL13110352 | 0.81 | MAPT (0.30) | — | |
| SCHEMBL2138228 | 0.80 | — | — | |
| SCHEMBL13050903 | 0.80 | — | — | |
| SCHEMBL271991 | 0.78 | — | — | |
| SCHEMBL6884754 | 0.76 | ELANE (0.30) | — | |
| SCHEMBL18219832 | 0.73 | — | — | |
| SCHEMBL14306948 | 0.73 | — | — | |
| SCHEMBL2140748 | 0.72 | — | — | |
| SCHEMBL4953989 | 0.71 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2387599-B1 | BLACK PIGMENT DISPERSION | BASF SE (DE) | 2013-03-20 | — | — | EP | disclosed |
| US-8134009-B2 | Process for the oxidation of secondary amines into the corresponding nitroxides | BASF SE (DE) | 2012-03-13 | — | — | US | disclosed |
| EP-2247678-B1 | FLUORO LEVELLING AGENTS | BASF SE (DE) | 2011-11-30 | — | — | EP | disclosed |
| WO-2010081756-A1 | BLACK PIGMENT DISPERSION | BASF SE (DE) | 2010-07-22 | — | — | WO | disclosed |
| WO-2009103613-A1 | FLUORO LEVELLING AGENTS | BASF SE (DE) | 2009-08-27 | — | — | WO | disclosed |
| WO-2009077396-A1 | BIODIESEL COLD FLOW IMPROVER | BASF SE (DE) | 2009-06-25 | — | — | WO | disclosed |