⚠ 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 | |
|---|---|---|---|---|
| Methacrylic Acid SCHEMBL27474128 | 1.00 | — | — | |
| Methacrylic Acid SCHEMBL18528878 | 0.82 | — | — | |
| Methacrylic Acid SCHEMBL27351365 | 0.81 | TDP1 (0.52) | — | |
| Methacrylic Acid SCHEMBL10718449 | 0.80 | — | — | |
| Methacrylic Acid SCHEMBL11235035 | 0.78 | TDP1 (0.53) | — | |
| Methacrylic Acid SCHEMBL491341 | 0.78 | TDP1 (0.53) | — | |
| Methacrylic Acid SCHEMBL15043 | 0.78 | TDP1 (0.53) | — | |
| Methacrylic Acid SCHEMBL13234423 | 0.78 | — | — | |
| Methacrylic Acid SCHEMBL15005463 | 0.78 | TDP1 (0.53) | — | |
| Methacrylic Acid SCHEMBL66252 | 0.78 | TDP1 (0.53) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116042016-A | Solvent for high-efficiency organic luminescent material ink and application thereof | 四川阿格瑞新材料有限公司 | 2023-05-02 | — | — | CN | disclosed |
| CN-109789222-B | Polymer particles | 泰尔茂株式会社 | 2022-02-25 | — | — | CN | disclosed |
| CN-114026180-A | Surface modified kaolin pigments and methods therefor | 巴斯夫公司 | 2022-02-08 | — | — | CN | disclosed |