⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12549120 | 0.97 | ALDH1A1 (0.30) | — | |
| SCHEMBL5587723 | 0.93 | — | — | |
| SCHEMBL28850866 | 0.93 | — | — | |
| SCHEMBL12744890 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL18529242 | 0.73 | — | — | |
| SCHEMBL17154313 | 0.71 | — | — | |
| SCHEMBL5073255 | 0.71 | CES2 (0.30) | — | |
| SCHEMBL9239388 | 0.71 | CES2 (0.30) | — | |
| SCHEMBL19407865 | 0.70 | ALDH1A1 (0.36) | — | |
| SCHEMBL7173810 | 0.70 | ALDH1A1 (0.36) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110105434-A | The polypeptide and application thereof of stitching and suture | 哈佛大学的校长及成员们 | 2019-08-09 | — | — | CN | disclosed |
| CN-105307667-B | Stapled and sutured polypeptides and uses thereof | 哈佛大学的校长及成员们 | 2019-04-19 | — | — | CN | disclosed |
| CN-104039799-B | As the macrocyclic amide of proteinase inhibitor | HOFFMAN-LA ROCHE LTD. (CH) | 2016-04-13 | — | — | CN | disclosed |
| CN-105307667-A | Stapled and sutured polypeptides and uses thereof | HARVARD COLLEGE | 2016-02-03 | — | — | CN | disclosed |
| CN-104380410-A | Devices and methods comprising polyacetylenes | POLYJOULE INC | 2015-02-25 | — | — | CN | disclosed |
| CN-104039799-A | Macrocyclic amides as protease inhibitors | HOFFMANN LA ROCHE | 2014-09-10 | — | — | CN | disclosed |
| CN-1823083-B | Lincomycin derivatives with antimicrobial activity | VICURON PHARM INC | 2010-05-26 | — | — | CN | disclosed |
| CN-1823083-A | Novel lincomycin derivatives with antimicrobial activity | VICURON PHARM INC (US) | 2006-08-23 | — | — | CN | disclosed |