⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18081952 | 0.83 | ATAD2 (0.31) | — | |
| SCHEMBL16631553 | 0.83 | KMT2A (0.33) | — | |
| SCHEMBL18080450 | 0.76 | LMNA (0.30) | — | |
| SCHEMBL16631495 | 0.72 | DAO (0.34) | — | |
| SCHEMBL16631912 | 0.72 | HSP90AA1 (0.33) | — | |
| SCHEMBL16631498 | 0.69 | PDE3B (0.30) | — | |
| SCHEMBL16631200 | 0.68 | SYNJ2 (0.39) | — | |
| SCHEMBL16631363 | 0.67 | — | — | |
| SCHEMBL16631746 | 0.67 | MAP4K1 (0.32) | — | |
| SCHEMBL18080487 | 0.64 | LMNA (0.30) | — |
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-2015051173-A2 | POLYNUCLEOTIDE MOLECULES AND USES THEREOF | MODERNA THERAPEUTICS, INC (US) | 2015-04-09 | — | — | WO | disclosed |