⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28189336 | 0.91 | TDP1 (1.00) | — | |
| SCHEMBL40685 | 0.91 | — | — | |
| Ethane SCHEMBL27843578 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL5701908 | 0.88 | — | — | |
| SCHEMBL28391317 | 0.86 | — | — | |
| Benzene SCHEMBL28301462 | 0.83 | TDP1 (0.83) | — | |
| Acrolein SCHEMBL20298472 | 0.75 | TDP1 (0.68) | — | |
| SCHEMBL442540 | 0.74 | — | — | |
| SCHEMBL31395499 | 0.72 | — | — | |
| SCHEMBL1009152 | 0.72 | — | — |
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-9206121-B2 | Method for the production of D,L-methionine | EVONIK DEGUSSA GMBH (DE) | 2015-12-08 | — | — | US | claimed |
| US-20150197489-A1 | METHOD FOR THE PRODUCTION OF D,L-METHIONINE | EVONIK DEGUSSA GMBH (DE) | 2015-07-16 | — | — | US | claimed |
| US-20140213819-A1 | METHOD FOR THE PRODUCTION OF 2-HYDROXY-4-(METHYLTHIO)BUTYRONITRILE FROM 3-(METHYLTHIO)PROPANAL AND HYDROGEN CYANIDE | EVONIK DEGUSSA GMBH (DE) | 2014-07-31 | — | — | US | claimed |