⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL230055 | 0.97 | — | — | |
| SCHEMBL27328861 | 0.94 | — | — | |
| SCHEMBL28308659 | 0.94 | — | — | |
| Acetone SCHEMBL27510054 | 0.94 | ALDH1A1 (0.50) | — | |
| SCHEMBL9732934 | 0.87 | ALDH1A1 (0.44) | — | |
| Bicarbonate SCHEMBL27688544 | 0.87 | ALDH1A1 (0.44) | — | |
| SCHEMBL28904181 | 0.84 | — | — | |
| SCHEMBL30175562 | 0.82 | ALDH1A1 (0.60) | — | |
| SCHEMBL9383751 | 0.82 | ALDH1A1 (0.60) | — | |
| SCHEMBL6276686 | 0.82 | ALDH1A1 (0.60) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115260504-B | Zwitterionic-containing polyarylethersulfone block copolymer, anti-pollution ultrafiltration membrane, preparation method and application | 中国科学院长春应用化学研究所 | 2023-08-29 | — | — | CN | claimed |
| CN-116422163-A | Method for modifying ultrafiltration membrane by combining zwitterionic structure and benzimidazole structure | 哈尔滨工程大学 | 2023-07-14 | — | — | CN | claimed |
| CN-115260504-A | Zwitterion-containing polyarylethersulfone block copolymer, anti-pollution ultrafiltration membrane, preparation method and application | 中国科学院长春应用化学研究所 | 2022-11-01 | — | — | CN | claimed |
| CN-119060018-A | N, N-diaryl urea derivative and application thereof | 杭州百新生物医药科技有限公司 | 2024-12-03 | — | — | CN | disclosed |
| CN-116422163-A | Method for modifying ultrafiltration membrane by combining zwitterionic structure and benzimidazole structure | 哈尔滨工程大学 | 2023-07-14 | — | — | CN | disclosed |