⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19662328 | 1.00 | — | — | |
| SCHEMBL855476 | 1.00 | — | — | |
| SCHEMBL10232278 | 1.00 | — | — | |
| SCHEMBL26085597 | 1.00 | — | — | |
| SCHEMBL855477 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL20983360 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL20983270 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL2730680 | 0.97 | — | — | |
| SCHEMBL22242701 | 0.88 | — | — | |
| SCHEMBL21974278 | 0.76 | SI (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105237560-A | LZC696 intermediate and synthetic method therefor | SHANGHAI BOC CHEMICAL CO LTD | 2016-01-13 | — | — | CN | claimed |
| CN-105237560-B | A kind of LZC696 intermediates and its synthetic method | 上海博氏医药科技有限公司 | 2018-07-06 | — | — | CN | disclosed |
| CN-105237560-A | LZC696 intermediate and synthetic method therefor | SHANGHAI BOC CHEMICAL CO LTD | 2016-01-13 | — | — | CN | disclosed |