⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29875652 | 0.82 | — | — | |
| SCHEMBL30153559 | 0.82 | — | — | |
| SCHEMBL2254018 | 0.82 | — | — | |
| SCHEMBL449403 | 0.82 | — | — | |
| SCHEMBL25507 | 0.82 | — | — | |
| SCHEMBL31330335 | 0.82 | — | — | |
| SCHEMBL29360125 | 0.82 | — | — | |
| SCHEMBL708004 | 0.82 | — | — | |
| SCHEMBL3748135 | 0.82 | — | — | |
| SCHEMBL29842640 | 0.82 | — | — |
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-6793903-B1 | GAS-PHASE OXIDATION OF NITRIC OXIDE TO NITROGEN DIOXIDE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION | 2004-09-21 | — | — | US | claimed |
| CN-109618561-B | Fuel cell device and method for manufacturing electrode material for fuel cell | 林科闯 | 2022-03-04 | — | — | CN | disclosed |