⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3132605 | 0.79 | — | — | |
| SCHEMBL10768329 | 0.68 | — | — | |
| SCHEMBL8082743 | 0.67 | — | — | |
| SCHEMBL560767 | 0.67 | — | — | |
| SCHEMBL18641983 | 0.67 | — | — | |
| SCHEMBL19126699 | 0.64 | — | — | |
| SCHEMBL3401203 | 0.63 | ALDH1A1 (0.36) | — | |
| SCHEMBL5066992 | 0.61 | — | — | |
| SCHEMBL17097355 | 0.61 | — | — | |
| SCHEMBL29133074 | 0.61 | TSHR (0.47) | — |
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-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-103073661-B | Magnesium dichloride-based adduct and catalytic component prepared therefrom | 巴塞尔聚烯烃意大利有限公司 | 2018-06-12 | — | — | CN | disclosed |
| CN-107531737-A | Synthesis of desosamine | 哈佛大学的校长及成员们 | 2018-01-02 | — | — | CN | disclosed |
| CN-105307667-A | Stapled and sutured polypeptides and uses thereof | HARVARD COLLEGE | 2016-02-03 | — | — | CN | disclosed |