⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4212942 | 0.73 | CA12 (0.31) | — | |
| SCHEMBL757252 | 0.73 | CA12 (0.31) | — | |
| SCHEMBL7518153 | 0.69 | — | — | |
| SCHEMBL7518146 | 0.69 | — | — | |
| SCHEMBL6864078 | 0.67 | — | — | |
| SCHEMBL7517564 | 0.66 | CYP2C9 (0.30) | — | |
| SCHEMBL7517580 | 0.66 | CYP2C9 (0.30) | — | |
| SCHEMBL1273918 | 0.65 | — | — | |
| SCHEMBL8626718 | 0.65 | NFKB1 (0.38) | — | |
| SCHEMBL22755458 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210332006-A1 | CARBON DIOXIDE-REVERSIBLY-PROTECTED CHAIN EXTENSION-CROSSLINKING AGENT AND PREPARATION METHOD AND USE THEREOF | CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2021-10-28 | — | — | US | claimed |
| EP-3862344-A1 | CARBON DIOXIDE REVERSIBLY PROTECTED CHAIN-EXTENDING CROSS-LINKING AGENT, PREPARATION METHOD THEREFOR AND USE THEREOF | Changchun Institute Of Applied Chemistry Chinese Academy Of Sciences (CN) | 2021-08-11 | — | — | EP | claimed |
| US-11401238-B2 | Carbon dioxide-reversibly-protected chain extension-crosslinking agent and preparation method and use thereof | CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2022-08-02 | — | — | US | disclosed |
| US-20210332006-A1 | CARBON DIOXIDE-REVERSIBLY-PROTECTED CHAIN EXTENSION-CROSSLINKING AGENT AND PREPARATION METHOD AND USE THEREOF | CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2021-10-28 | — | — | US | disclosed |
| EP-3862344-A1 | CARBON DIOXIDE REVERSIBLY PROTECTED CHAIN-EXTENDING CROSS-LINKING AGENT, PREPARATION METHOD THEREFOR AND USE THEREOF | Changchun Institute Of Applied Chemistry Chinese Academy Of Sciences (CN) | 2021-08-11 | — | — | EP | disclosed |