⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6217325 | 0.81 | — | — | |
| SCHEMBL1743388 | 0.72 | ALDH1A1 (0.48) | — | |
| SCHEMBL42956 | 0.72 | ALDH1A1 (0.48) | — | |
| SCHEMBL9452585 | 0.69 | ALDH1A1 (0.46) | — | |
| SCHEMBL10389154 | 0.69 | ALDH1A1 (0.46) | — | |
| SCHEMBL17401248 | 0.69 | ALDH1A1 (0.46) | — | |
| SCHEMBL9945703 | 0.69 | ALDH1A1 (0.46) | — | |
| SCHEMBL4323031 | 0.69 | ALDH1A1 (0.46) | — | |
| Potassium SCHEMBL2529395 | 0.69 | ALDH1A1 (0.46) | — | |
| Ethane SCHEMBL887641 | 0.69 | ALDH1A1 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1888532-A1 | HETEROAROYL-SUBSTITUTED SERINE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006125687-A1 | HETEROAROYL-SUBSTITUTED SERINE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-30 | — | — | WO | disclosed |
| US-5194369-A | Heterocyclic diamides as couplers | FUJI PHOTO FILM CO., LTD. (JP) | 1993-03-16 | — | — | US | disclosed |