⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13725004 | 0.73 | KDM4E (0.36) | — | |
| SCHEMBL16707486 | 0.63 | HTR2A (0.32) | — | |
| SCHEMBL13724789 | 0.61 | LMNA (0.31) | — | |
| SCHEMBL13724955 | 0.61 | KDM4E (0.40) | — | |
| SCHEMBL16707490 | 0.61 | HTR2A (0.31) | — | |
| SCHEMBL7872376 | 0.59 | KDM4E (0.39) | — | |
| SCHEMBL16910865 | 0.52 | — | — | |
| SCHEMBL9298670 | 0.51 | KDM4E (0.30) | — | |
| SCHEMBL246087 | 0.48 | — | — | |
| SCHEMBL8165655 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708090-B1 | Intermediates useful for the synthesis of pesticides | AVENTIS CROPSCIENCE SA (FR) | 2002-12-04 | — | — | EP | disclosed |
| US-6271392-B1 | Intermediates useful for the synthesis of 1-arylpyrrole pesticides | RHONE-POULENC INC. | 2001-08-07 | — | — | US | disclosed |
| EP-0708090-A1 | Intermediates useful for the synthesis of pesticides | RHONE-POULENC AGROCHIMIE (FR) | 1996-04-24 | — | — | EP | disclosed |