⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12712288 | 1.00 | — | — | |
| SCHEMBL1898928 | 0.97 | — | — | |
| SCHEMBL22228560 | 0.93 | — | — | |
| SCHEMBL22228555 | 0.85 | — | — | |
| SCHEMBL66407 | 0.82 | — | — | |
| SCHEMBL22228554 | 0.81 | — | — | |
| Ammonia Solution, Strong SCHEMBL27932780 | 0.79 | — | — | |
| SCHEMBL22228578 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL12716903 | 0.76 | NCF1 (0.33) | — | |
| SCHEMBL22228547 | 0.73 | NCF1 (0.38) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220396595-A1 | A METAL COMPLEX AND USE THEREOF | RHODIA OPERATIONS (FR) | 2022-12-15 | — | — | US | claimed |
| CN-114599772-A | Metal complexes and their use | 罗地亚经营管理公司 | 2022-06-07 | — | — | CN | claimed |
| US-20200231910-A1 | BLEACH OR DETERGENT COMPOSITION | RHODIA OPERATIONS (FR) | 2020-07-23 | — | — | US | claimed |
| US-20220396595-A1 | A METAL COMPLEX AND USE THEREOF | RHODIA OPERATIONS (FR) | 2022-12-15 | — | — | US | disclosed |
| CN-114599772-A | Metal complexes and their use | 罗地亚经营管理公司 | 2022-06-07 | — | — | CN | disclosed |
| US-20200231910-A1 | BLEACH OR DETERGENT COMPOSITION | RHODIA OPERATIONS (FR) | 2020-07-23 | — | — | US | disclosed |