⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11328885 | 0.77 | PTPN1 (0.38) | — | |
| SCHEMBL7268045 | 0.76 | — | — | |
| SCHEMBL473159 | 0.75 | MAOA (0.32) | — | |
| SCHEMBL28874540 | 0.75 | ABL1 (0.38) | — | |
| SCHEMBL28741713 | 0.74 | MAOA (0.31) | — | |
| Hydrochloric Acid SCHEMBL28432953 | 0.74 | MAOA (0.31) | — | |
| SCHEMBL28379974 | 0.74 | MAOA (0.31) | — | |
| SCHEMBL28379953 | 0.74 | MAOA (0.31) | — | |
| SCHEMBL28381602 | 0.74 | MAOA (0.31) | — | |
| SCHEMBL11331090 | 0.74 | MAOA (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8092661-B2 | Electropolymerisable monomers, soluble in an aqueous solution and comprising a metalloporphyrin | BIOMERIEUX (FR) | 2012-01-10 | — | — | US | disclosed |
| US-20090314660-A1 | Novel Electropolymerisable Monomers, Soluble in an Aqueous Solution and Comprising a Metalloporphyrin | BIOMERIEUX (FR) | 2009-12-24 | — | — | US | disclosed |