⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4955259 | 0.75 | LMNA (0.33) | — | |
| SCHEMBL14567103 | 0.75 | LMNA (0.33) | — | |
| SCHEMBL31558047 | 0.75 | — | — | |
| SCHEMBL8328254 | 0.73 | — | — | |
| SCHEMBL133922 | 0.73 | — | — | |
| SCHEMBL1613710 | 0.71 | GBA1 (0.36) | — | |
| Paraldehyde SCHEMBL6032642 | 0.71 | LMNA (1.00) | — | |
| Paraldehyde SCHEMBL22870 | 0.71 | — | — | |
| Paraldehyde SCHEMBL20072682 | 0.71 | — | — | |
| Metaldehyde SCHEMBL135215 | 0.71 | LMNA (1.00) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101309900-B | Substituted cycloalkene derivative | DAIICHI SANKYO CO LTD | 2015-04-22 | — | — | CN | disclosed |
| US-RE43858-E1 | Substituted cycloalkene derivative | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2012-12-11 | — | — | US | disclosed |
| US-7935835-B2 | Substituted cycloalkene derivative | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2011-05-03 | — | — | US | disclosed |
| US-20090233952-A1 | SUBSTITUTED CYCLOALKENE DERIVATIVE | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2009-09-17 | — | — | US | disclosed |
| CN-101309900-A | Substituted cycloalkene derivative | DAIICHI SANKYO CO LTD (JP) | 2008-11-19 | — | — | CN | disclosed |
| EP-1935879-A1 | SUBSTITUTED CYCLOALKENE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2008-06-25 | — | — | EP | disclosed |
| US-4968820-A | TWISTABLE | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-11-06 | — | — | US | disclosed |