SCHEMBL29634374

SCHEMBL29634374

CCC#CC[C@@H]1C(=O)CC[C@H]1CC(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AKR1C4 P17516 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
BRD4 O60885 1/20 0.33
PTGER2 P43116 4/20 0.32
PTGER4 P35408 2/20 0.32
PTGER3 P43115 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL11798100 1.00 AKR1C4 (0.41) AKR1C4AKR1C3AKR1C2BRD4PTGER2
SCHEMBL11220260 0.86 AKR1C4 (0.36) AKR1C4AKR1C3AKR1C2BRD4PTGER3
SCHEMBL11755975 0.84 AKR1C4 (0.57) AKR1C4AKR1C3AKR1C2
SCHEMBL11514658 0.80 AKR1C4 (0.48) AKR1C4AKR1C3AKR1C2BRD4PTGER2
SCHEMBL29785194 0.77 PTGER2 (0.44) AKR1C4AKR1C3AKR1C2BRD4PTGER2
SCHEMBL22125386 0.77 PTGER2 (0.44) AKR1C4AKR1C3AKR1C2BRD4PTGER2
SCHEMBL14764390 0.77 PTGER2 (0.44) AKR1C4AKR1C3AKR1C2BRD4PTGER2
SCHEMBL2477633 0.77 AKR1C4 (0.51) AKR1C4AKR1C3AKR1C2BRD4PTGER2
SCHEMBL2477632 0.77 AKR1C4 (0.51) AKR1C4AKR1C3AKR1C2BRD4PTGER2
Dihydrojasmonic Acid, Methyl Ester SCHEMBL17517758 0.76 PTGER2 (0.48) AKR1C4AKR1C3AKR1C2PTGER2PTGER4

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115477581-B Preparation method of high cis methyl dihydrojasmonate 安徽金禾合成材料研究院有限公司 2024-11-05 CN claimed
CN-121913912-A Preparation method of methyl dehydrojasmonate 山东顺成化学有限公司 2026-04-24 CN disclosed
CN-121913912-A Preparation method of methyl dehydrojasmonate 山东顺成化学有限公司 2026-04-24 CN disclosed
CN-118978439-A Preparation method of 2- (3-acetoxyl-2-pentylcyclopent-2-en-1-yl) methyl acetate 山东新和成药业有限公司 2024-11-19 CN disclosed
CN-115477581-B Preparation method of high cis methyl dihydrojasmonate 安徽金禾合成材料研究院有限公司 2024-11-05 CN disclosed
CN-115477581-B Preparation method of high cis methyl dihydrojasmonate 安徽金禾合成材料研究院有限公司 2024-11-05 CN disclosed
CN-117964485-A Method for preparing cis (1R, 2S) -methyl dihydrojasmonate by asymmetric catalytic hydrogenation 上海交通大学 2024-05-03 CN disclosed
CN-113929575-B Preparation method of (1R, 2S) -methyl dihydrojasmonate 上海应用技术大学 2023-05-30 CN disclosed
CN-115477581-A Preparation method of high-cis methyl dihydrojasmonate 安徽金禾化学材料研究所有限公司 2022-12-16 CN disclosed
US-11332789-B2 Compositions and methods for diagnosing and treating hyperlipidemia-related diseases TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2022-05-17 US disclosed