⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5992718 | 1.00 | — | — | |
| SCHEMBL18412179 | 0.75 | — | — | |
| SCHEMBL277738 | 0.73 | — | — | |
| SCHEMBL251419 | 0.71 | — | — | |
| SCHEMBL1468276 | 0.71 | — | — | |
| SCHEMBL17224732 | 0.69 | — | — | |
| SCHEMBL45172 | 0.69 | — | — | |
| SCHEMBL3264437 | 0.67 | — | — | |
| SCHEMBL3502009 | 0.63 | — | — | |
| SCHEMBL2531231 | 0.63 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6956052-B2 | Substituted pyrazolyl compounds for the treatment of inflammation | PHARMACIA CORPORATION (US) | 2005-10-18 | — | — | US | claimed |
| EP-3160594-A1 | PERSONAL CARE COMPOSITIONS AND METHODS | The Procter & Gamble Company (US) | 2017-05-03 | — | — | EP | disclosed |
| WO-2016003948-A1 | PERSONAL CARE COMPOSITIONS AND METHODS | THE PROCTER & GAMBLE COMPANY (US) | 2016-01-07 | — | — | WO | disclosed |
| US-20070270312-A1 | Heteroaroyl-Substituted Serineamides | BASF AKTIENGESELLSCHAFT (DE) | 2007-11-22 | — | — | US | disclosed |
| EP-1292579-A1 | SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRAZINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | Pharmacia Corporation (US) | 2003-03-19 | — | — | EP | disclosed |
| WO-2001087854-A1 | SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRAZINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | PHARMACIA CORPORATION (US) | 2001-11-22 | — | — | WO | disclosed |
| WO-2001087852-A1 | SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL URACILS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | PHARMACIA CORPORATION (US) | 2001-11-22 | — | — | WO | disclosed |