⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8081463 | 0.92 | — | — | |
| SCHEMBL8078335 | 0.90 | DNM1 (0.54) | — | |
| SCHEMBL8078540 | 0.90 | DNM1 (0.54) | — | |
| SCHEMBL8081402 | 0.90 | DNM1 (0.54) | — | |
| SCHEMBL8081447 | 0.90 | DNM1 (0.54) | — | |
| SCHEMBL8069185 | 0.90 | DNM1 (0.54) | — | |
| SCHEMBL8078380 | 0.90 | DNM1 (0.54) | — | |
| SCHEMBL8081372 | 0.90 | DNM1 (0.54) | — | |
| SCHEMBL8083521 | 0.90 | DNM1 (0.54) | — | |
| SCHEMBL8076684 | 0.83 | — | — |
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-105063795-B | A kind of preparation method of the polypropylene conductive fiber of doped graphene | 汕头市易通织造有限公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-1364161-A | N-substituted perhydrodiazines | BASF AG (DE) | 2002-08-14 | — | — | CN | disclosed |
| CN-1362950-A | Substituted ureas | BASF AG (DE) | 2002-08-07 | — | — | CN | disclosed |
| 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 |