⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1092237 | 0.84 | — | — | |
| SCHEMBL4648136 | 0.84 | — | — | |
| SCHEMBL27966890 | 0.84 | CA1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL28612889 | 0.83 | — | — | |
| SCHEMBL28282706 | 0.82 | — | — | |
| Sulfuric Acid SCHEMBL27512880 | 0.80 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL28942585 | 0.76 | — | — | |
| SCHEMBL1358372 | 0.76 | — | — | |
| Sulfuric Acid Dimethyl Ester SCHEMBL27503895 | 0.76 | — | — | |
| SCHEMBL28018524 | 0.75 | EPHX2 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111615523-A | Process for preparing polymer compositions | 巴斯夫欧洲公司 | 2020-09-01 | — | — | CN | disclosed |
| CN-109689704-A | The method for preparing polymer composition | 巴斯夫欧洲公司 | 2019-04-26 | — | — | CN | disclosed |