⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10139526 | 0.94 | — | — | |
| SCHEMBL13239253 | 0.89 | MAPT (0.32) | — | |
| SCHEMBL13159225 | 0.86 | — | — | |
| SCHEMBL60015 | 0.83 | MAPT (0.35) | — | |
| SCHEMBL12084072 | 0.81 | MAPT (0.33) | — | |
| SCHEMBL12998664 | 0.80 | MAPT (0.37) | — | |
| SCHEMBL4400175 | 0.79 | MAPT (0.34) | — | |
| SCHEMBL10052076 | 0.78 | MAPT (0.34) | — | |
| SCHEMBL58810 | 0.76 | XDH (0.41) | — | |
| SCHEMBL15233454 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090246378-A1 | Ink composition, ink set, and image recording method | FUJIFILM CORPORATION (JP) | 2009-10-01 | — | — | US | disclosed |