⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2998518 | 0.67 | CYP3A4 (0.32) | — | |
| SCHEMBL2992011 | 0.67 | — | — | |
| SCHEMBL487018 | 0.63 | — | — | |
| SCHEMBL8708051 | 0.63 | LMNA (0.32) | — | |
| SCHEMBL9805708 | 0.62 | — | — | |
| SCHEMBL486923 | 0.60 | TSHR (0.34) | — | |
| SCHEMBL886972 | 0.59 | — | — | |
| SCHEMBL2575329 | 0.59 | CYP3A4 (0.34) | — | |
| SCHEMBL10836392 | 0.59 | CYP3A4 (0.34) | — | |
| SCHEMBL2573206 | 0.59 | CYP3A4 (0.34) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1559772-A1 | LUBRICATING OIL | Nippon Oil Corporation (JP) | 2005-08-03 | — | — | EP | disclosed |