⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19064720 | 1.00 | — | — | |
| SCHEMBL7989737 | 1.00 | — | — | |
| SCHEMBL13502443 | 0.87 | SLC1A2 (0.33) | — | |
| SCHEMBL17740136 | 0.78 | SLC1A2 (0.47) | — | |
| SCHEMBL15571615 | 0.78 | SLC1A2 (0.47) | — | |
| SCHEMBL17740138 | 0.78 | SLC1A2 (0.47) | — | |
| SCHEMBL2071540 | 0.78 | SLC1A2 (0.47) | — | |
| SCHEMBL2032498 | 0.78 | SLC1A2 (0.47) | — | |
| SCHEMBL978535 | 0.78 | SLC1A2 (0.47) | — | |
| SCHEMBL17428705 | 0.77 | CHRNB2 (0.33) | — |
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-6291432-B1 | (R)-N-(2-METHYLBENZYL)-3-((2S, 3S)-3-(N-(2-CHROMONECARBONYL)-L-ASPARAGINYL)AMINO-2-HYDROXY-4-PHENYLBUTANO YL)-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE CAN BE GIVEN AS A TYPICAL EXAMPLE OF THIS COMPOUND. | JAPAN ENERGY CORPORATION (JP) | 2001-09-18 | — | — | US | disclosed |
| EP-0900566-A1 | NOVEL TRIPEPTIDE COMPOUNDS AND ANTI-AIDS DRUGS | JAPAN ENERGY CORPORATION (JP) | 1999-03-10 | — | — | EP | disclosed |
| US-4321392-A | Mercaptoacyl derivatives of 4-oxazolidine-carboxylic acids | E. R. SQUIBB & SONS, INC. (US) | 1982-03-23 | — | — | US | disclosed |