⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11303860 | 1.00 | — | — | |
| SCHEMBL18094449 | 0.77 | — | — | |
| SCHEMBL8973062 | 0.76 | — | — | |
| SCHEMBL1969649 | 0.76 | — | — | |
| SCHEMBL9398110 | 0.76 | — | — | |
| SCHEMBL10926656 | 0.76 | — | — | |
| SCHEMBL2363663 | 0.76 | — | — | |
| SCHEMBL9541497 | 0.75 | — | — | |
| SCHEMBL7082278 | 0.75 | — | — | |
| SCHEMBL4778227 | 0.75 | ALDH1A1 (0.32) | — |
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-119822938-B | Method for synthesizing 2- (3-hydroxypropyl) cyclododecanone | 万华化学集团股份有限公司 | 2026-05-19 | — | — | CN | disclosed |
| CN-119822938-B | Method for synthesizing 2- (3-hydroxypropyl) cyclododecanone | 万华化学集团股份有限公司 | 2026-05-19 | — | — | CN | disclosed |
| CN-119822938-A | Method for synthesizing 2- (3-hydroxypropyl) cyclododecanone | 万华化学集团股份有限公司 | 2025-04-15 | — | — | CN | disclosed |
| CN-119822938-A | Method for synthesizing 2- (3-hydroxypropyl) cyclododecanone | 万华化学集团股份有限公司 | 2025-04-15 | — | — | CN | disclosed |