⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9500789 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL27490263 | 0.98 | CA2 (0.40) | — | |
| SCHEMBL2792653 | 0.79 | — | — | |
| SCHEMBL594482 | 0.79 | — | — | |
| SCHEMBL22414041 | 0.79 | CA2 (0.47) | — | |
| SCHEMBL594483 | 0.79 | — | — | |
| Lithium Ion SCHEMBL28676082 | 0.78 | CA2 (0.41) | — | |
| SCHEMBL28930407 | 0.78 | CA2 (0.41) | — | |
| SCHEMBL28262449 | 0.77 | MME (0.41) | — | |
| Hydrazine SCHEMBL27924753 | 0.77 | RAB9A (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0353361-B1 | A METHOD FOR DETECTING AMINO ACID DERIVATIVES | SEIKO INSTRUMENTS INC. (JP) | 1993-04-28 | — | — | EP | disclosed |
| US-5051369-A | Formation of fluorescein or rhodamine derivatives of amino compounds to form phenylthiocarbamyl aminoacids and detection by fluorescence | SEIKO INSTRUMENTS INC. (JP) | 1991-09-24 | — | — | US | disclosed |
| EP-0353361-A1 | A method for detecting amino acid derivatives | SEIKO INSTRUMENTS INC. (JP) | 1990-02-07 | — | — | EP | disclosed |