⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6468448 | 0.85 | — | — | |
| SCHEMBL19262830 | 0.85 | PRMT3 (0.30) | — | |
| SCHEMBL13923699 | 0.82 | CA12 (0.40) | — | |
| SCHEMBL14037572 | 0.78 | — | — | |
| SCHEMBL10060786 | 0.77 | TDP1 (0.32) | — | |
| SCHEMBL10073920 | 0.74 | — | — | |
| SCHEMBL23487565 | 0.73 | ALDH1A1 (0.42) | — | |
| SCHEMBL12444629 | 0.72 | LMNA (0.38) | — | |
| SCHEMBL15617402 | 0.72 | — | — | |
| SCHEMBL22944191 | 0.68 | PAOX (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120040918-A9 | PEPTIDE NUCLEIC ACID DERIVATIVES WITH GOOD CELL PENETRATION AND STRONG AFFINITY FOR NUCLEIC ACID | CTI BIO (KR) | 2012-02-16 | — | — | US | disclosed |
| US-20110178031-A1 | PEPTIDE NUCLEIC ACID DERIVATIVES WITH GOOD CELL PENETRATION AND STRONG AFFINITY FOR NUCLEIC ACID | CTI BIO (KR) | 2011-07-21 | — | — | US | disclosed |