⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24243939 | 0.74 | — | — | |
| SCHEMBL13459557 | 0.70 | — | — | |
| Boric Acid SCHEMBL5067672 | 0.67 | — | — | |
| Nitrous Acid SCHEMBL21951230 | 0.63 | — | — | |
| Boric Acid SCHEMBL21951435 | 0.60 | LMNA (0.80) | — | |
| Nitrous Acid SCHEMBL10526485 | 0.54 | — | — | |
| Nitrous Acid SCHEMBL20212027 | 0.54 | — | — | |
| Boric Acid SCHEMBL3922229 | 0.54 | — | — | |
| Boric Acid SCHEMBL9444194 | 0.54 | — | — | |
| Nitrous Acid SCHEMBL2328305 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1905829-B1 | Templated molecules and methods for using such molecules | NUEVOLUTION AS (DK) | 2016-02-17 | — | — | EP | disclosed |