⚠ 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 | |
|---|---|---|---|---|
| Nitrogen SCHEMBL175740 | 1.00 | — | — | |
| Nitrogen SCHEMBL6395401 | 1.00 | — | — | |
| Nitrogen SCHEMBL38 | 1.00 | — | — | |
| Nitrogen SCHEMBL163 | 0.82 | — | — | |
| Nitrogen SCHEMBL7777729 | 0.82 | — | — | |
| Nitrogen SCHEMBL729051 | 0.82 | — | — | |
| Nitrogen SCHEMBL461636 | 0.82 | — | — | |
| Nitrogen SCHEMBL3261354 | 0.82 | — | — | |
| Nitrogen SCHEMBL692938 | 0.82 | — | — | |
| Nitrogen SCHEMBL696576 | 0.82 | — | — |
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-113748344-A | Detection of risk of pre-eclampsia in obese pregnant women | 代谢组学诊断有限公司 | 2021-12-03 | — | — | CN | disclosed |
| CN-112105931-A | Methods for predicting preeclampsia preterm labor using metabolic and protein biomarkers | 代谢组学诊断有限公司 | 2020-12-18 | — | — | CN | disclosed |
| CN-102321403-A | Magnetic resonance and luminescent material composite anti-counterfeiting ink | SHENZHEN LEAGUER ANTI COUNTERFEITING TECHNOLOGY CO LTD | 2012-01-18 | — | — | CN | disclosed |
| EP-0425662-A4 | NUCLEAR RESONANCES IN ACTIVATION ANALYSIS, AND PARTICULARLY, ITS APPLICATION TO DETECTION OF NITROGEN BASED EXPLOSIVES IN LUGGAGE | — | 1992-08-12 | — | — | EP | disclosed |
| EP-0425662-A1 | NUCLEAR RESONANCES IN ACTIVATION ANALYSIS, AND PARTICULARLY, ITS APPLICATION TO DETECTION OF NITROGEN BASED EXPLOSIVES IN LUGGAGE. | SCIENT INNOVATIONS INC (US) | 1991-05-08 | — | — | EP | disclosed |
| WO-1990013811-A1 | NUCLEAR RESONANCES IN ACTIVATION ANALYSIS, AND PARTICULARLY, ITS APPLICATION TO DETECTION OF NITROGEN BASED EXPLOSIVES IN LUGGAGE | SCIENTIFIC INNOVATIONS, INC. (US) | 1990-11-15 | — | — | WO | disclosed |