⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8076857 | 0.93 | OPRM1 (0.36) | — | |
| SCHEMBL8078525 | 0.91 | OPRM1 (0.34) | — | |
| SCHEMBL8078235 | 0.91 | OPRM1 (0.34) | — | |
| SCHEMBL8083168 | 0.91 | OPRM1 (0.34) | — | |
| SCHEMBL8076639 | 0.91 | OPRM1 (0.34) | — | |
| SCHEMBL8078557 | 0.85 | — | — | |
| SCHEMBL3875953 | 0.80 | — | — | |
| SCHEMBL26265915 | 0.78 | — | — | |
| SCHEMBL11303488 | 0.78 | OPRM1 (0.56) | — | |
| SCHEMBL1794453 | 0.76 | OPRM1 (0.54) | — |
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 |