⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1928411 | 0.80 | — | — | |
| SCHEMBL19520818 | 0.80 | — | — | |
| SCHEMBL1929444 | 0.80 | — | — | |
| SCHEMBL27865772 | 0.74 | — | — | |
| SCHEMBL10003987 | 0.74 | — | — | |
| SCHEMBL537913 | 0.74 | — | — | |
| SCHEMBL222668 | 0.74 | — | — | |
| SCHEMBL8720628 | 0.70 | — | — | |
| SCHEMBL27957636 | 0.69 | PDE4A (0.46) | — | |
| SCHEMBL28131184 | 0.68 | TDP1 (0.55) | — |
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-2010115935-A1 | SYNTHESIS OF 2 ' -O-FUCOSYLLACTOSE | GLYCOM A/S (DK) | 2010-10-14 | — | — | WO | disclosed |