⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6687775 | 0.96 | — | — | |
| SCHEMBL9420958 | 0.96 | ALDH1A1 (0.53) | — | |
| SCHEMBL14498560 | 0.96 | — | — | |
| SCHEMBL60727 | 0.96 | — | — | |
| SCHEMBL11627934 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL1839190 | 0.93 | — | — | |
| Putrescine SCHEMBL10868083 | 0.87 | OPRM1 (0.46) | — | |
| Bicarbonate SCHEMBL3387529 | 0.82 | GABRP (0.56) | — | |
| Sulfuric Acid SCHEMBL10353223 | 0.80 | TP53 (0.58) | — | |
| SCHEMBL22022653 | 0.80 | ALDH1A1 (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119875036-A | Gas wetting agent suitable for tight sandstone reservoir and preparation method thereof | 中国石油天然气股份有限公司 | 2025-04-25 | — | — | CN | claimed |
| CN-114032054-A | VOC-free aqueous polyurethane adhesive for medicine packaging and preparation method thereof | 汉中聚智达远环能科技有限公司 | 2022-02-11 | — | — | CN | claimed |
| CN-119875036-A | Gas wetting agent suitable for tight sandstone reservoir and preparation method thereof | 中国石油天然气股份有限公司 | 2025-04-25 | — | — | CN | disclosed |
| CN-114032054-A | VOC-free aqueous polyurethane adhesive for medicine packaging and preparation method thereof | 汉中聚智达远环能科技有限公司 | 2022-02-11 | — | — | CN | disclosed |