SCHEMBL29645002

SCHEMBL29645002

CC(=O)/C=C/[C@@H](CCC(C)=O)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.30
LMNA P02545 1/20 0.30
SLC15A2 Q16348 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL11438241 1.00 ALDH1A1 (0.35) ALDH1A1TDP1LMNASLC15A2
SCHEMBL11438237 1.00 ALDH1A1 (0.35) ALDH1A1TDP1LMNASLC15A2
SCHEMBL8780842 0.86 GABRP (0.42) ALDH1A1LMNASLC15A2
SCHEMBL8780844 0.86 GABRP (0.42) ALDH1A1LMNASLC15A2
SCHEMBL24089836 0.85 ALDH1A1 (0.32) ALDH1A1
SCHEMBL322675 0.85 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5306207 0.85 ALDH1A1 (0.32) ALDH1A1
SCHEMBL24092017 0.85 ALDH1A1 (0.32) ALDH1A1
SCHEMBL3505826 0.85 ALDH1A1 (0.32) ALDH1A1
SCHEMBL19260226 0.85 ALDH1A1 (0.32) ALDH1A1

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024252653-A1 TOBACCO MATERIAL, PRODUCTION METHOD, AND SMOKING ARTICLE 日本たばこ産業株式会社 2024-12-12 WO claimed
CN-118415381-A Tobacco extract rich in solanone and norsolanedione, and preparation method and application thereof 山东中烟工业有限责任公司 2024-08-02 CN claimed
EP-4260715-A1 APPLICATION OF SPHERICAL CARBON IN FLUE GAS ADSORPTION OF HEAT-NOT-BURN TOBACCO PRODUCT Shenzhen Global Greenland New Materials Co., Ltd. (CN) 2023-10-18 EP claimed
CN-114680373-A Application of spherical carbon in flue gas adsorption of heating non-combustible tobacco products 深圳市环球绿地新材料有限公司 2022-07-01 CN claimed
EP-3094193-B1 PROCESS FOR PRODUCING FLAVORANTS AND RELATED MATERIALS REYNOLDS TOBACCO CO R (US) 2025-09-03 EP disclosed
CN-115011721-B DNA molecular marker for identifying density of tobacco glandular hairs and application thereof 河南中烟工业有限责任公司 2025-05-09 CN disclosed
CN-119655488-A Inapplicable tobacco leaf extract for heating cigarettes and preparation method thereof 贵州省烟草科学研究院 2025-03-21 CN disclosed
CN-119350128-A Method for extracting and separating cembratriene diol by deep eutectic solvent 合肥工业大学 2025-01-24 CN disclosed
US-20250024877-A1 METHOD FOR EXTRACTION OF TOBACCO FLAVORS FROM AGED TOBACCO LEAVES XERBAL USA LLC (US) 2025-01-23 US disclosed
WO-2025019040-A1 METHOD FOR EXTRACTION OF TOBACCO FLAVORS FROM AGED TOBACCO LEAVES XERBAL USA, LLC (US) 2025-01-23 WO disclosed
CN-116106437-B Method for simultaneously extracting and measuring components of tobacco ether extract and glandular Mao Fenbi 浙江中烟工业有限责任公司 2025-01-21 CN disclosed
CN-119310224-A High-purity chiral compound separation and collection system 重庆中烟工业有限责任公司 2025-01-14 CN disclosed
WO-2023026391-A1 TOBACCO CONSUMABLE MATERIAL FOR INHALER AND INHALER 日本たばこ産業株式会社 2023-03-02 WO disclosed
CN-113281128-B A preceding processing extraction element for determining tobacco leaf glandular hair secretion content 河南农业大学 2023-01-31 CN disclosed
CN-115011721-A DNA molecular marker for identifying glandular hair density of tobacco and application thereof 河南中烟工业有限责任公司 2022-09-06 CN disclosed
CN-111004104-B (Z) -type solanone, preparation method and application thereof 云南中烟工业有限责任公司 2022-08-19 CN disclosed
CN-114747795-A Tobacco absolute oil, preparation method thereof, smoking substrate and tobacco product 贵州中烟工业有限责任公司 2022-07-15 CN disclosed
CN-114680373-A Application of spherical carbon in flue gas adsorption of heating non-combustible tobacco products 深圳市环球绿地新材料有限公司 2022-07-01 CN disclosed
CN-110140993-B Tobacco-derived components and materials R·J·雷诺兹烟草公司 2022-07-01 CN disclosed
CN-110140993-B Tobacco-derived components and materials R·J·雷诺兹烟草公司 2022-07-01 CN disclosed