⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12646575 | 0.81 | FUT8 (0.38) | — | |
| SCHEMBL12173082 | 0.81 | FUT8 (0.38) | — | |
| SCHEMBL13764095 | 0.79 | FUT8 (0.38) | — | |
| SCHEMBL20390575 | 0.74 | FUT8 (0.40) | — | |
| SCHEMBL16373350 | 0.74 | CARM1 (0.35) | — | |
| SCHEMBL12589893 | 0.74 | FUT8 (0.35) | — | |
| SCHEMBL12173125 | 0.71 | FUT8 (0.35) | — | |
| SCHEMBL13763511 | 0.71 | CAMK2D (0.31) | — | |
| SCHEMBL12053415 | 0.69 | FUT8 (0.38) | — | |
| SCHEMBL16626829 | 0.68 | FUT8 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010149505-A2 | CHARGED PARTICLES | BASF SE (DE) | 2010-12-29 | — | — | WO | disclosed |