⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2428834 | 1.00 | — | — | |
| SCHEMBL7056990 | 1.00 | — | — | |
| SCHEMBL2621359 | 1.00 | — | — | |
| SCHEMBL278517 | 1.00 | — | — | |
| SCHEMBL16336286 | 1.00 | — | — | |
| Methoxymethane SCHEMBL4465609 | 0.90 | KDM4E (0.36) | — | |
| Acetic Acid SCHEMBL4650043 | 0.86 | KDM4E (0.42) | — | |
| SCHEMBL2691547 | 0.82 | KDM4E (0.32) | — | |
| SCHEMBL7030413 | 0.82 | KDM4E (0.40) | — | |
| SCHEMBL958080 | 0.81 | KDM4E (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20080051533-A1 | Metal catalyst for olefin polymerization and co-polymerization with functional monomers | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2008-02-28 | — | — | US | disclosed |
| US-5342767-A | Transferring a hydride ion from an R-configured alcohol to the pro-R face of nicotinamide adenine dinucleotide phosphate | THE SCRIPPS RESEARCH INSTITUTE (US) | 1994-08-30 | — | — | US | disclosed |
| US-5225339-A | NADPH <--> NADP | THE SCRIPPS RESEARCH INSTITUTE (US) | 1993-07-06 | — | — | US | disclosed |