⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7903854 | 0.97 | ALDH1A1 (0.35) | — | |
| SCHEMBL1262713 | 0.97 | ALDH1A1 (0.35) | — | |
| SCHEMBL30304789 | 0.97 | ALDH1A1 (0.35) | — | |
| SCHEMBL12549289 | 0.88 | — | — | |
| SCHEMBL8135758 | 0.88 | ALDH1A1 (0.40) | — | |
| SCHEMBL8658121 | 0.85 | ALDH1A1 (0.38) | — | |
| Formic Acid SCHEMBL31350858 | 0.84 | HPGD (0.38) | — | |
| SCHEMBL2510810 | 0.84 | TSHR (0.50) | — | |
| SCHEMBL14062956 | 0.80 | ALDH1A1 (0.35) | — | |
| SCHEMBL942441 | 0.77 | ALDH1A1 (0.36) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102725273-B | Inclusion compound and manufacture method thereof | NIPPON SODA CO.,LTD. (JP) | 2016-02-17 | — | — | CN | disclosed |
| CN-105121402-A | Novel inclusion compound | NIPPON SODA CO | 2015-12-02 | — | — | CN | disclosed |
| EP-1279667-B1 | PROCESS FOR PRODUCING 1,3-DIALKYL-2-IMIDAZOLIDINONE COMPOUND | MITSUI CHEMICALS INC (JP) | 2010-10-27 | — | — | EP | disclosed |
| US-6861534-B2 | Process for producing 1,3-dialkyl-2-imidazolidinone compound | MITSUI CHEMICALS, INC. (JP) | 2005-03-01 | — | — | US | disclosed |
| EP-1279667-A1 | PROCESS FOR PRODUCING 1,3-DIALKYL-2-IMIDAZOLIDINONE COMPOUND | Mitsui Chemicals, Inc. (JP) | 2003-01-29 | — | — | EP | disclosed |
| US-20030009035-A1 | Process for producing 1,3-dialkyl-2-imidazolidinone compound | MITSUI CHEMICALS, INC. (JP) | 2003-01-09 | — | — | US | disclosed |