⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14327866 | 0.75 | ALDH1A1 (0.31) | — | |
| SCHEMBL15115450 | 0.74 | ALOX5 (0.45) | — | |
| SCHEMBL15115447 | 0.74 | ALOX5 (0.45) | — | |
| SCHEMBL10062276 | 0.72 | GAA (0.30) | — | |
| SCHEMBL11800952 | 0.72 | — | — | |
| SCHEMBL21119049 | 0.70 | — | — | |
| SCHEMBL9063923 | 0.70 | — | — | |
| SCHEMBL16276994 | 0.68 | — | — | |
| SCHEMBL15791834 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL4271507 | 0.67 | ESR2 (0.35) | — |
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 127 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118235851-A | Powder coating additive, powder coating and fried food | 丰益(上海)生物技术研发中心有限公司 | 2024-06-25 | — | — | CN | claimed |
| US-12004553-B2 | Method for extracting tar aroma components from within cigarette butts and application thereof in cigarettes | INNER MONGOLIA KUNMING CIGARETTE CO., LTD. (CN) | 2024-06-11 | — | — | US | claimed |
| CN-117384709-A | Cigarette-used incense-based module, essence and heating cigarette capable of improving mouth-to-mouth smoking consistency | 中国烟草总公司郑州烟草研究院 | 2024-01-12 | — | — | CN | claimed |
| US-11839232-B2 | Method for preparing tar extract having aromatic characteristics by using discarded cigarette butt, and use thereof in cigarette | INNER MONGOLIA KUNMING CIGARETTE CO., LTD. (CN) | 2023-12-12 | — | — | US | claimed |
| CN-117110481-A | Auxiliary determination method for unknown ketone-containing perfume in tobacco essence | 吉林烟草工业有限责任公司 | 2023-11-24 | — | — | CN | claimed |
| CN-111849632-B | Deep processing method of natural fragrant raw material for cigarettes and application of natural fragrant raw material in novel tobacco | 云南养瑞科技集团有限公司 | 2023-06-20 | — | — | CN | claimed |
| CN-113812667-B | Tobacco aroma component dry distillation extraction equipment and method | 浙江中烟工业有限责任公司 | 2023-05-05 | — | — | CN | claimed |
| CN-115852731-A | Whole hemp pulp for heating non-combustible cigarettes and application thereof | 广东中烟工业有限责任公司 | 2023-03-28 | — | — | CN | claimed |
| CN-113812667-A | Dry distillation extraction equipment and method for tobacco aroma components | 浙江中烟工业有限责任公司 | 2021-12-21 | — | — | CN | claimed |
| CN-105925376-B | The essence of the quick-fried pearl of cigarette and its application | 红塔辽宁烟草有限责任公司 | 2019-11-19 | — | — | CN | claimed |
| CN-108891183-A | A kind of wicker products film thermal transfer printing method | 阜南县慧宏柳木工艺品有限公司 | 2018-11-27 | — | — | CN | claimed |
| CN-108542062-A | A kind of jewel blasting craft | 辽宁机电职业技术学院 | 2018-09-18 | — | — | CN | claimed |
| CN-108323827-A | A kind of electronic cigarette atomizing liquid | 东莞市鸿馥生物科技有限公司 | 2018-07-27 | — | — | CN | claimed |
| CN-106398866-A | Flavor threshold-based essence for flue-cured, sweet and fragrant cigarette and blending method thereof | 河南中烟工业有限责任公司 | 2017-02-15 | — | — | CN | claimed |
| CN-105925376-A | Essence for cigarette blasting bead and application thereof | 红塔辽宁烟草有限责任公司 | 2016-09-07 | — | — | CN | claimed |
| CN-105510090-A | Gathering device and detection system and method for volatile aroma substances generated by heating tobacco | CHINA TOBACCO FUJIAN IND CO LTD | 2016-04-20 | — | — | CN | claimed |
| CN-105473002-A | 1H-PYRROLE-2,4-DICARBONYL-DERIVATIVES AND THEIR USE AS FLAVORING AGENTS | FRESENIUS KABI DE GMBH | 2016-04-06 | — | — | CN | claimed |
| CN-101597224-B | Method for synthesizing ethylcyclopentenolone | CUNZHAO CHENG | 2012-07-25 | — | — | CN | claimed |
| CN-102076226-A | Sweetener, method for producing sweetener and use thereof | CARGILL INC | 2011-05-25 | — | — | CN | claimed |
| CN-101597224-A | The synthetic method of ethylcyclopentenolone | CUNZHAO CHENG (CN) | 2009-12-09 | — | — | CN | claimed |