⚠ 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 | |
|---|---|---|---|---|
| Sarcosine SCHEMBL29286554 | 0.90 | MCL1 (0.39) | — | |
| Sarcosine SCHEMBL2327706 | 0.87 | MCL1 (0.37) | — | |
| Sarcosine SCHEMBL26675067 | 0.87 | — | — | |
| Sarcosine SCHEMBL8907159 | 0.87 | — | — | |
| Sarcosine SCHEMBL22689538 | 0.84 | — | — | |
| Sarcosine SCHEMBL156329 | 0.84 | LDHA (0.44) | — | |
| Sarcosine SCHEMBL31427574 | 0.84 | — | — | |
| Sarcosine SCHEMBL28259932 | 0.84 | — | — | |
| Sarcosine SCHEMBL149 | 0.84 | — | — | |
| Sarcosine SCHEMBL26641423 | 0.84 | LDHA (0.44) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0754679-A1 | Process for the preparation of creatin or creatine-monohydrate | SKW Trostberg Aktiengesellschaft (DE) | 1997-01-22 | — | — | EP | disclosed |