⚠ 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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL3888555 | 0.75 | — | — | |
| Sulfuric Acid SCHEMBL27386910 | 0.70 | — | — | |
| SCHEMBL22260775 | 0.67 | CA5A (0.46) | — | |
| Sulfuric Acid SCHEMBL9509012 | 0.64 | CA5A (0.75) | — | |
| Sulfuric Acid SCHEMBL715887 | 0.64 | CA5A (0.75) | — | |
| Sulfuric Acid SCHEMBL8612638 | 0.64 | CA5A (0.75) | — | |
| Sulfuric Acid SCHEMBL8595596 | 0.64 | CA5A (0.75) | — | |
| Sulfuric Acid SCHEMBL94403 | 0.64 | — | — | |
| Sulfuric Acid SCHEMBL363576 | 0.64 | — | — | |
| Sulfuric Acid SCHEMBL18616 | 0.64 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7913541-B2 | Acoustic wave sensing devices; enhanced sensing due to the amino groups reacting with CO2 | HONEYWELL INTERNATIONAL INC. (US) | 2011-03-29 | — | — | US | disclosed |
| EP-1988390-A2 | Matrix nanocomposite containing aminocarbon nanotubes for carbon dioxide detection | Honeywell International Inc. (US) | 2008-11-05 | — | — | EP | disclosed |
| US-20080264147-A1 | Matrix nanocomposite containing aminocarbon nanotubes for carbon dioxide sensor detection | HONEYWELL INTERNATIONAL INC. | 2008-10-30 | — | — | US | disclosed |