⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6440505 | 1.00 | — | — | |
| SCHEMBL8391671 | 0.83 | — | — | |
| SCHEMBL6440301 | 0.82 | MEP1B (0.30) | — | |
| SCHEMBL6440305 | 0.82 | MEP1B (0.30) | — | |
| SCHEMBL8388430 | 0.81 | MAPT (0.33) | — | |
| SCHEMBL8309730 | 0.80 | — | — | |
| SCHEMBL8309731 | 0.80 | — | — | |
| SCHEMBL8489453 | 0.78 | HPGD (0.47) | — | |
| SCHEMBL8725799 | 0.77 | MAPT (0.32) | — | |
| SCHEMBL8309793 | 0.77 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1066237-B1 | PROCESSES FOR PREPARING INTERMEDIATES | BAYER CROPSCIENCE SA (FR) | 2005-07-20 | — | — | EP | disclosed |
| US-6642418-B1 | 1,3-dione compounds from beta keto esters | AVENTIS CROPSCIENCE SA (FR) | 2003-11-04 | — | — | US | disclosed |
| EP-1066237-A2 | PROCESSES FOR PREPARING INTERMEDIATES | AVENTIS CROPSCIENCE S.A. (FR) | 2001-01-10 | — | — | EP | disclosed |
| WO-1999048851-A2 | PROCESSES FOR PREPARING INTERMEDIATES | AVENTIS CROPSCIENCE S.A. (FR) | 1999-09-30 | — | — | WO | disclosed |