⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18571463 | 0.92 | TRPV1 (0.45) | — | |
| SCHEMBL20385954 | 0.89 | — | — | |
| SCHEMBL10798330 | 0.88 | TRPV1 (0.50) | — | |
| SCHEMBL18880179 | 0.84 | — | — | |
| SCHEMBL284016 | 0.84 | — | — | |
| SCHEMBL6682836 | 0.84 | — | — | |
| SCHEMBL17993940 | 0.82 | — | — | |
| SCHEMBL16359908 | 0.82 | — | — | |
| SCHEMBL284090 | 0.82 | — | — | |
| SCHEMBL40004 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015078889-A1 | NEW ENZYMES AND METHOD FOR PREPARING HYDROXYLATED L-LYSINE OR L-ORNITHINE AND ANALOGS THEREOF | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2015-06-04 | — | — | WO | disclosed |
| EP-2876156-A1 | New enzymes and method for preparing hydroxylated L-lysine or L-ornithine and analogs thereof | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2015-05-27 | — | — | EP | disclosed |