⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10400684 | 0.98 | ALOX15 (0.42) | — | |
| SCHEMBL2855507 | 0.80 | ALDH1A1 (0.46) | — | |
| SCHEMBL2868181 | 0.80 | ALDH1A1 (0.46) | — | |
| SCHEMBL10571663 | 0.80 | — | — | |
| SCHEMBL5613333 | 0.80 | — | — | |
| SCHEMBL30829428 | 0.80 | — | — | |
| SCHEMBL1422129 | 0.78 | — | — | |
| SCHEMBL7662336 | 0.78 | — | — | |
| SCHEMBL11148340 | 0.78 | ALDH1A1 (0.43) | — | |
| SCHEMBL7889814 | 0.78 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0030870-B1 | PROCESS FOR PRODUCING SOLUTIONS OF AZIRIDINE-2-CARBOXYLIC ACID SALT | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1985-03-20 | — | — | EP | disclosed |
| EP-0030475-B1 | PROCESS FOR PRODUCING SOLUTIONS OF AZIRIDINE-2-CARBOXYLIC ACID SALTS | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1984-03-14 | — | — | EP | disclosed |
| US-4304933-A | HEATING AZIRIDINE-2-CARBOXYLIC ACID ON ION EXCHANGE RESIN | MITSUI TOATSU CHEMICALS, INC. (JP) | 1981-12-08 | — | — | US | disclosed |
| EP-0030870-A1 | Process for producing solutions of aziridine-2-carboxylic acid salt | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1981-06-24 | — | — | EP | disclosed |
| EP-0030474-A1 | Process for the production of DL-serines | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1981-06-17 | — | — | EP | disclosed |