⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28088039 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL28200556 | 0.76 | LMNA (0.30) | — | |
| SCHEMBL20819089 | 0.76 | — | — | |
| SCHEMBL456591 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL27582992 | 0.71 | HIF1A (0.42) | — | |
| Hydrochloric Acid SCHEMBL27586817 | 0.71 | — | — | |
| SCHEMBL27111321 | 0.69 | PLK4 (0.35) | — | |
| SCHEMBL1770184 | 0.69 | PLK4 (0.35) | — | |
| SCHEMBL2957382 | 0.69 | — | — | |
| Pimagedine SCHEMBL28296497 | 0.69 | NOS1 (0.41) | — |
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-1802731-B1 | METHOD FOR THE TRANSESTERIFICATION OF FATS AND OILS OF BIOLOGICAL ORIGIN BY MEANS OF ALCOHOLYSIS USING SPECIFIC CARBONATES | PETER DR WOLFGANG (DE) | 2008-05-21 | — | — | EP | claimed |
| EP-1802731-A1 | METHOD FOR THE TRANSESTERIFICATION OF FATS AND OILS OF BIOLOGICAL ORIGIN BY MEANS OF ALCOHOLYSIS USING SPECIFIC CARBONATES | Peter, Siegfried, Prof. Dr. (DE) | 2007-07-04 | — | — | EP | claimed |
| WO-2006029655-A1 | METHOD FOR THE TRANSESTERIFICATION OF FATS AND OILS OF BIOLOGICAL ORIGIN BY MEANS OF ALCOHOLYSIS USING SPECIFIC CARBONATES | PETER SIEGFRIED (DE) | 2006-03-23 | — | — | WO | claimed |