⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1245107 | 1.00 | — | — | |
| SCHEMBL7451666 | 0.93 | TRPA1 (0.61) | — | |
| SCHEMBL7451658 | 0.93 | TRPA1 (0.61) | — | |
| SCHEMBL9915041 | 0.93 | TRPA1 (0.61) | — | |
| SCHEMBL2416572 | 0.91 | TRPA1 (0.59) | — | |
| SCHEMBL11439697 | 0.91 | TRPA1 (0.59) | — | |
| SCHEMBL8907239 | 0.91 | TRPA1 (0.59) | — | |
| SCHEMBL10675600 | 0.91 | TRPA1 (0.59) | — | |
| SCHEMBL2416574 | 0.91 | TRPA1 (0.59) | — | |
| SCHEMBL12300775 | 0.91 | TRPA1 (0.59) | — |
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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8592621-B2 | Precursor compounds of sweet taste receptor antagonists for the prevention or treatment of disease | SYMRISE AG (DE) | 2013-11-26 | — | — | US | claimed |
| US-20110045069-A1 | PRECURSOR COMPOUNDS OF SWEET TASTE RECEPTOR ANTAGONISTS FOR THE PREVENTION OR TREATMENT OF DISEASE | SYMRISE GMBH CO. KG (DE) | 2011-02-24 | — | — | US | claimed |
| US-6071973-A | TREATING AREA OR OBJECT WITH ANT REPELLENT COMPRISING ALCOHOL HAVING 6 TO 14 CARBON ATOMS SELECTED FROM 1-HEPTANOL, 2-HEPTANOL, 1-NONANOL, 2-NONANOL, (1-DECANOL), 2-DODECANOL, (1-TETRADECANOL), 1-OCTYN-3-OL, 1-OCTEN-3-OL, 2-OCTEN-4-OL | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 2000-06-06 | — | — | US | claimed |
| WO-1994003058-A1 | REPELLENTS FOR ANTS | UNITED STATES OF AMERICA, AS REPRESENTED BY THE SE (US) | 1994-02-17 | — | — | WO | claimed |
| EP-0196595-B1 | FLAVOUR AND FLAVOUR COMPOSITIONS CONTAINING IT | HAARMANN & REIMER GMBH (DE) | 1988-06-01 | — | — | EP | claimed |
| US-4710392-A | CHERRY AROMA | HAARMANN & REIMER GMBH (DE) | 1987-12-01 | — | — | US | claimed |
| EP-0196595-A1 | Flavour and flavour compositions containing it | HAARMANN & REIMER GMBH (DE) | 1986-10-08 | — | — | EP | claimed |
| US-20240410055-A1 | METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS | MERCK PATENT GMBH (DE) | 2024-12-12 | — | — | US | disclosed |
| US-20240277012-A1 | DUPLICATE BEVERAGE | WANG JIE (US) | 2024-08-22 | — | — | US | disclosed |
| CN-118076767-A | Method and formulation for producing an optical metal oxide layer | 默克专利有限公司 | 2024-05-24 | — | — | CN | disclosed |
| US-11958859-B2 | Use of pyridoxal acetal salts as water-triggered pro-fragrances | FLORIDA GULF COAST UNIVERSITY BOARD OF TRUSTEES (US) | 2024-04-16 | — | — | US | disclosed |
| US-20240108040-A1 | HIGH INTENSITY SWEETENERS | FIRMENICH INCORPORATED (US) | 2024-04-04 | — | — | US | disclosed |
| EP-3743410-B1 | USE OF PYRIDOXAL ACETAL SALTS AS WATER-TRIGGERED PROFRAGRANCES | FLORIDA GULF COAST UNIV BOARD OF TRUSTEES (US) | 2023-10-25 | — | — | EP | disclosed |
| US-4710392-A | CHERRY AROMA | HAARMANN & REIMER GMBH (DE) | 1987-12-01 | — | — | US | disclosed |
| US-4710392-A | CHERRY AROMA | HAARMANN & REIMER GMBH (DE) | 1987-12-01 | — | — | US | disclosed |
| US-4710392-A | CHERRY AROMA | HAARMANN & REIMER GMBH (DE) | 1987-12-01 | — | — | US | disclosed |
| EP-0196595-A1 | Flavour and flavour compositions containing it | HAARMANN & REIMER GMBH (DE) | 1986-10-08 | — | — | EP | disclosed |
| EP-0196595-A1 | Flavour and flavour compositions containing it | HAARMANN & REIMER GMBH (DE) | 1986-10-08 | — | — | EP | disclosed |
| US-4111917-A | POLYURETHANES | W. R. GRACE & CO. (US) | 1978-09-05 | — | — | US | disclosed |
| US-4105697-A | Process for the preparation of α, β-ethylenic aldehydes | RHONE-POULENC INDUSTRIES (FR) | 1978-08-08 | — | — | US | disclosed |