⚠ 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 | |
|---|---|---|---|---|
| Nitric Acid SCHEMBL27884352 | 0.70 | — | — | |
| Nitric Acid SCHEMBL1433664 | 0.70 | — | — | |
| Nitric Acid SCHEMBL215496 | 0.70 | — | — | |
| Nitrous Acid SCHEMBL5835143 | 0.70 | CA1 (0.50) | — | |
| Nitrous Acid SCHEMBL30311491 | 0.70 | CA1 (0.50) | — | |
| Nitric Acid SCHEMBL9058784 | 0.70 | CA5A (0.67) | — | |
| Nitrous Acid SCHEMBL8902788 | 0.70 | — | — | |
| Nitrous Acid SCHEMBL2184394 | 0.70 | — | — | |
| Nitric Acid SCHEMBL3471224 | 0.70 | CA5A (0.67) | — | |
| Nitric Acid SCHEMBL11018828 | 0.70 | CA5A (0.67) | — |
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-1992004350-A1 | OXYGENATED QUINOXALINES | THE UPJOHN COMPANY (US) | 1992-03-19 | — | — | WO | disclosed |