⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13384048 | 0.86 | P2RY2 (0.43) | — | |
| SCHEMBL13384047 | 0.80 | HINT1 (0.34) | — | |
| SCHEMBL13384043 | 0.78 | DOT1L (0.33) | — | |
| SCHEMBL5576435 | 0.73 | LMNA (0.36) | — | |
| SCHEMBL17749433 | 0.72 | ST6GAL1 (0.42) | — | |
| SCHEMBL9297806 | 0.72 | LMNA (0.52) | — | |
| SCHEMBL2629584 | 0.71 | P2RY6 (0.34) | — | |
| SCHEMBL5183563 | 0.71 | LMNA (0.34) | — | |
| SCHEMBL1582603 | 0.70 | LMNA (0.35) | — | |
| SCHEMBL14015353 | 0.69 | P2RY14 (0.42) | — |
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-20100087634-A1 | Fluorous Oligonucleotide Reagents and Affinity Purification of Oligonucleotides | BERRY & ASSOCIATES, INC. (US) | 2010-04-08 | — | — | US | disclosed |