⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31173911 | 0.82 | — | — | |
| Fluoride SCHEMBL31133419 | 0.68 | — | — | |
| SCHEMBL14721708 | 0.61 | — | — | |
| SCHEMBL24604 | 0.61 | — | — | |
| SCHEMBL444758 | 0.61 | — | — | |
| Ammonia Solution, Strong SCHEMBL9317182 | 0.55 | — | — | |
| Hydrochloric Acid SCHEMBL10488807 | 0.55 | — | — | |
| SCHEMBL2043839 | 0.55 | — | — | |
| SCHEMBL2044940 | 0.55 | — | — | |
| Water SCHEMBL2687435 | 0.55 | — | — |
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-119930894-A | PAG bonding type photosensitive photoresist resin and preparation method thereof | 杭州先研科技有限公司 | 2025-05-06 | — | — | CN | disclosed |
| CN-115667242-A | Tetrahydroisoquinoline compounds as NRF2 activators | 希四克斯探索有限公司 | 2023-01-31 | — | — | CN | disclosed |
| CN-103649263-B | Direct trifluoromethylation using trifluoromethane | 南加州大学 | 2016-06-29 | — | — | CN | disclosed |
| CN-102712660-A | Compounds containing perfluoroalkyl-cyano-alkoxy-borate anions or perfluoroalkyl-cyano-alkoxy-fluoro-borate anions | MERCK PATENT GMBH | 2012-10-03 | — | — | CN | disclosed |
| EP-2081908-A1 | PROCESS FOR THE SULFINYLATION OF A PYRAZOLE DERIVATIVE | BASF SE (DE) | 2009-07-29 | — | — | EP | disclosed |
| WO-2008055877-A1 | PROCESS FOR THE SULFINYLATION OF A PYRAZOLE DERIVATIVE | BASF SE (DE) | 2008-05-15 | — | — | WO | disclosed |