⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10885990 | 0.78 | — | — | |
| SCHEMBL6827852 | 0.77 | — | — | |
| SCHEMBL5643160 | 0.76 | — | — | |
| SCHEMBL5644585 | 0.76 | — | — | |
| SCHEMBL10439395 | 0.76 | ALDH1A1 (0.41) | — | |
| SCHEMBL947089 | 0.76 | — | — | |
| SCHEMBL4657208 | 0.76 | — | — | |
| SCHEMBL10885987 | 0.76 | — | — | |
| SCHEMBL2013521 | 0.76 | — | — | |
| SCHEMBL571231 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1140794-B1 | NOVEL METHOD FOR PREPARING CHIRAL AMINO ACIDS | BAYER CROPSCIENCE SA (FR) | 2004-01-21 | — | — | EP | claimed |
| EP-0551048-B1 | 2-imidazoline-5-one and 2-imidazoline-5-thiones derivatives as fungizides | AVENTIS CROPSCIENCE SA (FR) | 2002-08-07 | — | — | EP | claimed |
| EP-1076718-B1 | NOVEL METHOD FOR PREPARING SYNTHESIS INTERMEDIATES | AVENTIS CROPSCIENCE SA (FR) | 2002-05-02 | — | — | EP | claimed |
| US-6551816-B1 | Enzyme-catalysed enantiomeric enrichment | RHONE-POULENC AGRO (FR) | 2003-04-22 | — | — | US | disclosed |
| US-4914206-A | ANTIBIOTICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-04-03 | — | — | US | disclosed |