⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21018459 | 0.79 | — | — | |
| SCHEMBL13765143 | 0.72 | — | — | |
| SCHEMBL13667216 | 0.67 | — | — | |
| SCHEMBL17919936 | 0.65 | SIGMAR1 (0.50) | — | |
| SCHEMBL919372 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL14744246 | 0.63 | — | — | |
| SCHEMBL12580604 | 0.62 | SIGMAR1 (0.42) | — | |
| SCHEMBL22204438 | 0.61 | — | — | |
| SCHEMBL1680312 | 0.61 | — | — | |
| SCHEMBL26707963 | 0.61 | SIGMAR1 (0.37) | — |
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-20070254304-A1 | Helicase-dependent amplification of nucleic acids | NEW ENGLAND BIOLABS, INC. (US) | 2007-11-01 | — | — | US | disclosed |