⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1131454 | 1.00 | — | — | |
| SCHEMBL10342959 | 0.87 | TDP1 (0.37) | — | |
| SCHEMBL1262446 | 0.82 | SLC22A6 (0.50) | — | |
| SCHEMBL9215751 | 0.80 | TDP1 (0.35) | — | |
| SCHEMBL6734706 | 0.79 | SLC22A6 (0.47) | — | |
| SCHEMBL1132152 | 0.79 | — | — | |
| SCHEMBL8424707 | 0.78 | — | — | |
| SCHEMBL4851976 | 0.78 | — | — | |
| SCHEMBL7920481 | 0.76 | SLC22A6 (0.39) | — | |
| SCHEMBL11527420 | 0.76 | — | — |
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-6903233-B2 | Process for producing optically active 3-halogenocarboxylic acid ester and 3-azidocarboxylic acid ester | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2005-06-07 | — | — | US | disclosed |
| US-20030225301-A1 | Process for producing optically active 3-halogenocarboxylic acid ester and 3-azidocarboxylic acid ester | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2003-12-04 | — | — | US | disclosed |
| EP-1344763-A1 | Process for producing optically active 3-halogenocarboxylic acid esters and 3-azide-carboxylic acid esters | Takasago International Corporation (JP) | 2003-09-17 | — | — | EP | disclosed |