⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL135337 | 0.71 | — | — | |
| SCHEMBL11122834 | 0.61 | — | — | |
| SCHEMBL8028679 | 0.50 | — | — | |
| SCHEMBL31091799 | 0.50 | — | — | |
| SCHEMBL9327805 | 0.50 | — | — | |
| SCHEMBL26688313 | 0.50 | — | — | |
| SCHEMBL2495976 | 0.50 | — | — | |
| SCHEMBL7886573 | 0.50 | — | — | |
| SCHEMBL2701509 | 0.50 | — | — | |
| SCHEMBL2315993 | 0.35 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116075354-A | Copper and nitrogen treated adsorbent and method for preparing same | 卡尔冈碳素公司 | 2023-05-05 | — | — | CN | disclosed |
| CN-106132542-A | Hydrogenation catalyst and preparation method thereof | 科莱恩国际有限公司 | 2016-11-16 | — | — | CN | disclosed |
| US-5795553-A | Nitrogen oxide adsorbing material | LOW EMMISSIONS TECHNOLOGIES RESEARCH AND DEVELOPMENT PARTNERSHIP (US) | 1998-08-18 | — | — | US | disclosed |
| WO-1998000223-A1 | NITROGEN OXIDE ADSORBING MATERIAL | LOW EMISSIONS TECHNOLOGIES RESEARCH AND DEVELOPMENT PARTNERSHIP (US) | 1998-01-08 | — | — | WO | disclosed |