⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22862335 | 0.83 | TAAR1 (0.76) | — | |
| SCHEMBL22130289 | 0.81 | — | — | |
| SCHEMBL13798845 | 0.79 | — | — | |
| SCHEMBL13647285 | 0.76 | TAAR1 (0.53) | — | |
| SCHEMBL27824330 | 0.76 | TAAR1 (0.53) | — | |
| SCHEMBL26789468 | 0.75 | TAAR1 (0.51) | — | |
| SCHEMBL22862337 | 0.72 | TAAR1 (0.49) | — | |
| SCHEMBL22862314 | 0.72 | TAAR1 (0.57) | — | |
| SCHEMBL13235015 | 0.72 | TAAR1 (1.00) | — | |
| SCHEMBL13041359 | 0.71 | TAAR1 (0.47) | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0002881-A1 | 5-Isoxazolylurea derivatives, their preparation, their use and compositions containing them | FISONS plc (GB) | 1979-07-11 | — | — | EP | claimed |
| JP-61047480-A | — | — | None | — | — | JP | disclosed |
| JP-1186882-A | — | — | None | — | — | JP | disclosed |
| US-10399933-B2 | Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer | BRISTOL-MYERS SQUIBB COMPANY (US) | 2019-09-03 | — | — | US | disclosed |
| US-20180072660-A1 | INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER | BRISTOL MYERS SQUIBB CO (US) | 2018-03-15 | — | — | US | disclosed |
| US-20120149706-A1 | INHIBITION OF P38 KINASE ACTIVITY USING SUBSTITUTED HETEROCYCLIC UREAS | DUMAS JACQUES (US) | 2012-06-14 | — | — | US | disclosed |
| US-20120046290-A1 | INHIBITION OF P38 KINASE ACTIVITY USING SUBSTITUTED HETEROCYCLIC UREAS | BAYER HEALTHCARE LLC | 2012-02-23 | — | — | US | disclosed |
| CN-1544420-A | Inhibition of raf kinase using substituted heterocyclic ureas | — | 2004-11-10 | — | — | CN | disclosed |
| CN-1149085-C | Inhibition of RAF kinase with substituted heterocyclic ureas | — | 2004-05-12 | — | — | CN | disclosed |
| CN-1290164-A | Inhibition of RAF kinase with substituted heterocyclic ureas | BAYER AG (US) | 2001-04-04 | — | — | CN | disclosed |
| JP-H01186882-A | 1,2,4-OXADIAZINE DERIVATIVE, PRODUCTION THEREOF AND HERBICIDE | OTSUKA CHEM CO LTD | 1989-07-26 | — | — | JP | disclosed |
| JP-S6147480-A | DIHYDROURACIL DERIVATIVE, ITS PREPARATION, AND HERBICIDE CONTAINING SAID DERIVATIVE AS ACTIVE COMPONENT | OTSUKA CHEM CO LTD | 1986-03-07 | — | — | JP | disclosed |
| EP-0034456-B1 | 3-(SUBSTITUTED 3- OR 5-ISOXAZOLYL)-1-4-, OR 5-SUBSTITUTED-2-IMIDAZOLIDINONES, METHODS FOR THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THEIR USE AS HERBICIDES | PPG INDUSTRIES, INC. (US) | 1984-08-15 | — | — | EP | disclosed |
| EP-0114456-A2 | Acylated isoxazolyl ureas, their preparation, herbicidal formulations containing the same, and a herbicidal method | SHIONOGI & CO., LTD. (JP) | 1984-08-01 | — | — | EP | disclosed |
| EP-0002881-A1 | 5-Isoxazolylurea derivatives, their preparation, their use and compositions containing them | FISONS plc (GB) | 1979-07-11 | — | — | EP | disclosed |
| EP-0002881-A1 | 5-Isoxazolylurea derivatives, their preparation, their use and compositions containing them | FISONS plc (GB) | 1979-07-11 | — | — | EP | disclosed |
| JP-S06147480-A | — | — | 0001-01-01 | — | — | JP | disclosed |