⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL27869127 | 0.98 | — | — | |
| SCHEMBL310711 | 0.93 | — | — | |
| Alcohol SCHEMBL28289077 | 0.91 | HDAC2 (0.48) | — | |
| SCHEMBL11041758 | 0.91 | HDAC2 (0.55) | — | |
| SCHEMBL621702 | 0.91 | HDAC2 (0.55) | — | |
| SCHEMBL11247934 | 0.91 | HDAC2 (0.55) | — | |
| SCHEMBL1229915 | 0.91 | HDAC2 (0.55) | — | |
| SCHEMBL11038707 | 0.91 | HDAC2 (0.55) | — | |
| SCHEMBL11036333 | 0.91 | HDAC2 (0.55) | — | |
| SCHEMBL11041765 | 0.91 | HDAC2 (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 1207 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110536611-A | Method | BRITISH AMERICAN TOBACCO INVESTMENTS LTD | 2019-12-03 | — | — | CN | claimed |
| CN-110522066-A | Fragrance module formula and fragrance for heating the cigarette that do not burn and heating are not burnt the preparation method of cigarette | SICHUAN SANLIAN NEW MAT CO LTD | 2019-12-03 | — | — | CN | claimed |
| CN-209659596-U | Loudspeaker | AAC TECHNOLOGIES SINGAPORE CO LTD | 2019-11-19 | — | — | CN | claimed |
| CN-106047486-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 | 2019-11-08 | — | — | CN | claimed |
| CN-110393290-A | A kind of allotment type egg yolk fruit essence and preparation method thereof | SHANGHAI INST TECH | 2019-11-01 | — | — | CN | claimed |
| CN-110387288-A | A kind of soursop essence and preparation method thereof | 广州馨杰添加剂有限公司 | 2019-10-29 | — | — | CN | claimed |
| CN-110367507-A | A kind of durian essence and preparation method thereof | 广东馨杰生化科技有限公司 | 2019-10-25 | — | — | CN | claimed |
| CN-106418687-B | A kind of preparation of new cigarette sweet material and its application method | 湖北中烟工业有限责任公司 | 2019-09-10 | — | — | CN | claimed |
| CN-106398866-B | It is a kind of that fragrant and sweet type flavouring essence for tobacco and its concocting method are baked based on fragrance threshold value | 河南中烟工业有限责任公司 | 2019-08-27 | — | — | CN | claimed |
| CN-110101055-A | A kind of coffee type edible essence and its production technology | 苏州禾田香料有限公司 | 2019-08-09 | — | — | CN | claimed |
| CN-101092382-A | Method for synthesizing cool flavour agent (5-MPC) of derivative of alpha ketone enamine, and application | RUISHENG TOBACCO TECH GROUP CO (CN) | 2007-12-26 | — | — | CN | claimed |
| CN-101069542-A | Cane-sugar taste agent | BAIRUN FUDE ESSENCE AND PERFUM (CN) | 2007-11-14 | — | — | CN | claimed |
| CN-1861060-A | Permeability nose absorption type medicine for treating and preventing senile dementia, improving learning memory faculty and regulating blood brain barrier | LI GUANGWU (CN) | 2006-11-15 | — | — | CN | claimed |
| CN-1625974-A | Method for producing essence | LI XIANGYING (CN) | 2005-06-15 | — | — | CN | claimed |
| CN-1582504-A | Encapsulation structure that acts as a multilayer mirror | UNIVERSAL DISPLAY CORP (US) | 2005-02-16 | — | — | CN | claimed |
| CN-1428388-A | Composition for chemical mechanical polishing of metal and metal/electric medium structure | BAYER AG (DE) | 2003-07-09 | — | — | CN | claimed |
| CN-1101153-C | Stabilisation of flavours | BRITISH AMERICAN TOBACCO INC (GB) | 2003-02-12 | — | — | CN | claimed |
| CN-1357585-A | Chemical and mechanical polishing paste for metal and dielectric structure | BAYER AG (DE) | 2002-07-10 | — | — | CN | claimed |
| CN-1135860-A | Atomized cigarette | XU DU (CN) | 1996-11-20 | — | — | CN | claimed |
| CN-1031560-A | A kind of method of producing essence by the Chinese torreya duricrust | HE FENGXIAN (CN) | 1989-03-08 | — | — | CN | claimed |