⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4276346 | 0.67 | — | — | |
| SCHEMBL15519760 | 0.67 | — | — | |
| SCHEMBL6422379 | 0.59 | — | — | |
| SCHEMBL201927 | 0.59 | — | — | |
| SCHEMBL420924 | 0.59 | — | — | |
| SCHEMBL6436737 | 0.59 | — | — | |
| Hydrochloric Acid SCHEMBL11470445 | 0.56 | — | — | |
| SCHEMBL10398195 | 0.56 | — | — | |
| SCHEMBL17875025 | 0.56 | — | — | |
| SCHEMBL16451434 | 0.56 | — | — |
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-103305192-A | High-temperature heat transfer oil composition | CHINA PETROLEUM & CHEMICAL | 2013-09-18 | — | — | CN | claimed |
| US-20230167067-A1 | PHOTOREDOX-CATALYZED DIRECT C-H FUNCTIONALIZATION OF ARENES | UNIV NORTH CAROLINA CHAPEL HILL (US) | 2023-06-01 | — | — | US | disclosed |
| US-20180148414-A1 | PHOTOREDOX-CATALYZED DIRECT C-H FUNCTIONALIZATION OF ARENES | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL | 2018-05-31 | — | — | US | disclosed |
| US-9498540-B2 | Cell proliferation inhibitors and conjugates thereof | NOVARTIS AG (CH) | 2016-11-22 | — | — | US | disclosed |
| US-20150216970-A1 | METHODS OF TREATING CANCER USING PD-1 AXIS BINDING ANTAGONISTS AND TIGIT INHIBITORS | GENENTECH INC. | 2015-08-06 | — | — | US | disclosed |
| US-20120136164-A1 | NANOSTRUCTURED METALS | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2012-05-31 | — | — | US | disclosed |