⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL821606 | 0.93 | — | — | |
| Hydroxyl Radical SCHEMBL932643 | 0.57 | — | — | |
| SCHEMBL4685684 | 0.57 | — | — | |
| SCHEMBL929348 | 0.57 | — | — | |
| Ammonia Solution, Strong SCHEMBL5697195 | 0.51 | — | — | |
| SCHEMBL1846678 | 0.51 | — | — | |
| SCHEMBL15797702 | 0.51 | CA2 (0.36) | — | |
| Iodide SCHEMBL9818601 | 0.51 | — | — | |
| SCHEMBL1559737 | 0.46 | — | — | |
| SCHEMBL5869492 | 0.46 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2323996-B1 | LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES | PROMEGA CORP (US) | 2014-10-22 | — | — | EP | disclosed |
| US-8288559-B2 | Luminogenic compounds and methods to detect cytochrome P450 3A enzymes | PROMEGA CORPORATION (US) | 2012-10-16 | — | — | US | disclosed |
| EP-2323996-A1 | LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES | Promega Corporation (US) | 2011-05-25 | — | — | EP | disclosed |
| US-20100062470-A1 | LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES | PROMEGA CORPORATION (US) | 2010-03-11 | — | — | US | disclosed |
| WO-2010021686-A1 | LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES | PROMEGA CORPORATION (US) | 2010-02-25 | — | — | WO | disclosed |