⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12921552 | 0.79 | MEN1 (0.35) | — | |
| SCHEMBL12921553 | 0.76 | MAPT (0.37) | — | |
| SCHEMBL20111040 | 0.76 | PRF1 (0.34) | — | |
| SCHEMBL15581044 | 0.75 | RARB (0.39) | — | |
| SCHEMBL25165550 | 0.73 | HSD17B1 (0.35) | — | |
| SCHEMBL19419246 | 0.72 | PPARG (0.33) | — | |
| SCHEMBL13712368 | 0.72 | MEN1 (0.32) | — | |
| SCHEMBL85799 | 0.71 | LTB4R (0.40) | — | |
| SCHEMBL85705 | 0.71 | LTB4R (0.41) | — | |
| SCHEMBL85806 | 0.71 | LTB4R (0.41) | — |
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-20180122585-A1 | PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME | FUJIFILM CORPORATION (JP) | 2018-05-03 | — | — | US | disclosed |