⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5320628 | 0.80 | TSHR (0.54) | — | |
| SCHEMBL8608290 | 0.80 | — | — | |
| SCHEMBL27877629 | 0.77 | CYP2D6 (0.56) | — | |
| SCHEMBL11133802 | 0.76 | — | — | |
| SCHEMBL371069 | 0.75 | TSHR (0.54) | — | |
| Acetaldehyde SCHEMBL27411506 | 0.74 | TSHR (0.48) | — | |
| SCHEMBL10141202 | 0.73 | — | — | |
| SCHEMBL28298 | 0.73 | — | — | |
| SCHEMBL21114388 | 0.73 | TSHR (0.57) | — | |
| SCHEMBL302811 | 0.73 | — | — |
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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109651223-B | Separation and analysis method of nitrogen and oxygen containing compounds in petroleum | 中国石油大学(北京) | 2021-03-02 | — | — | CN | claimed |
| CN-105777782-A | Two crystal structures of cantharidimide dipolymer derivative, preparation method and application | 齐鲁工业大学 | 2016-07-20 | — | — | CN | claimed |
| CN-102947288-A | Dithiin derivatives as fungicides | BAYER CROPSCIENCE AG | 2013-02-27 | — | — | CN | claimed |
| CN-1875061-A | Uv stabilizing additive composition | CYTEC TECH CORP (US) | 2006-12-06 | — | — | CN | claimed |
| CN-1230434-C | Indazolyl-substituted pyrroline compounds as kinase inhibitor | ORTHO MCNEL PHARMACEUTICAL INC (US) | 2005-12-07 | — | — | CN | claimed |
| CN-115010707-A | Process for preparing quinolopyrrole derivatives | 淮阴师范学院 | 2022-09-06 | — | — | CN | disclosed |
| CN-111176022-B | Display panel, preparation method thereof and display device | TCL华星光电技术有限公司 | 2022-02-22 | — | — | CN | disclosed |
| CN-108299270-B | Preparation method of disubstituted pyrrole compound | 中国科学院宁波材料技术与工程研究所 | 2021-08-17 | — | — | CN | disclosed |
| CN-107973741-B | Synthesis method of 1H-pyrrole-2, 5-diketone derivative | 重庆文理学院 | 2021-06-15 | — | — | CN | disclosed |
| CN-107973741-B | Synthesis method of 1H-pyrrole-2, 5-diketone derivative | 重庆文理学院 | 2021-06-15 | — | — | CN | disclosed |
| CN-107973741-B | Synthesis method of 1H-pyrrole-2, 5-diketone derivative | 重庆文理学院 | 2021-06-15 | — | — | CN | disclosed |
| CN-109651223-B | Separation and analysis method of nitrogen and oxygen containing compounds in petroleum | 中国石油大学(北京) | 2021-03-02 | — | — | CN | disclosed |
| WO-1994013615-A1 | HIGH PURITY FATTY ACID SALT PRODUCTS | CHURCH & DWIGHT COMPANY, INC. (US) | 1994-06-23 | — | — | WO | disclosed |
| WO-1993018665-A1 | DEODORIZED FATTY ACID SALT FEED SUPPLEMENT | CHURCH & DWIGHT COMPANY, INC. (US) | 1993-09-30 | — | — | WO | disclosed |
| US-5215768-A | Reacting fatty acid with alkaline earth compound; reacting alkali bisulfite with carbonyl impurity | CHURCH & DWIGHT CO., INC. (US) | 1993-06-01 | — | — | US | disclosed |
| US-4138410-A | Flavoring agent | FIRMENICH & CIE (CH) | 1979-02-06 | — | — | US | disclosed |
| US-4126618-A | FLAVOR ADDITIVES FOR FOODS AND BEVERAGES | FIRMENICH & CIE (CH) | 1978-11-21 | — | — | US | disclosed |
| US-4085109-A | Pyridine sulfur flavoring agents | FIRMENICH & CIE (CH) | 1978-04-18 | — | — | US | disclosed |
| US-3952024-A | FLAVOR ADDITIVE FOR FOODS AND BEVERAGES | FIRMENICH & CIE (CH) | 1976-04-20 | — | — | US | disclosed |
| US-3943260-A | TETRAHYDRO-THIO-PHEN-3-ONES | FIRMENICH & CIE (CH) | 1976-03-09 | — | — | US | disclosed |