⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8078301 | 0.83 | TSHR (0.39) | — | |
| SCHEMBL3855605 | 0.79 | — | — | |
| SCHEMBL2379126 | 0.77 | LMNA (0.32) | — | |
| SCHEMBL16594818 | 0.77 | TSHR (0.31) | — | |
| SCHEMBL11390750 | 0.77 | ALDH1A1 (0.37) | — | |
| SCHEMBL8076785 | 0.76 | — | — | |
| SCHEMBL306389 | 0.75 | TSHR (0.40) | — | |
| SCHEMBL27534610 | 0.75 | — | — | |
| SCHEMBL3362240 | 0.74 | — | — | |
| SCHEMBL4634958 | 0.71 | ADH1B (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0846679-B1 | Process for preparing 1,3-disubstituted urea | SUMIKA FINE CHEMICALS CO LTD (JP) | 2000-09-06 | — | — | EP | disclosed |
| US-5902899-A | Process for preparing 1, 3-disubstituted urea | SUMIKA FINE CHEMICALS CO., LTD. (JP) | 1999-05-11 | — | — | US | disclosed |
| EP-0846679-A2 | Process for preparing 1,3-disubstituted urea | SUMIKA FINE CHEMICALS Co., Ltd. (JP) | 1998-06-10 | — | — | EP | disclosed |