SCHEMBL28484221

SCHEMBL28484221

CCCCCC1=C(COC(C)=O)CCC1=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
HIF1A Q16665 1/20 0.38
SCD O00767 1/20 0.35
CDC25A P30304 6/20 0.35
CDC25B P30305 6/20 0.35
CDC25C P30307 5/20 0.35
PRKCA P17252 2/20 0.34
ELANE P08246 1/20 0.33
EPHX1 P07099 1/20 0.33
FAAH O00519 1/20 0.33
TSHR P16473 2/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
ALOX5 P09917 3/20 0.32
MPEG1 Q2M385 1/20 0.32

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
SCHEMBL5234137 0.81 ALDH1A1 (0.39) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL7175309 0.79 ALDH1A1 (0.38) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL7187409 0.78 SCD (0.40) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL4297676 0.77 ALDH1A1 (0.40) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL4441878 0.77 ALDH1A1 (0.39) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL4237197 0.76 ALDH1A1 (0.46) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL2142693 0.76 ALDH1A1 (0.38) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL4247967 0.75 ALDH1A1 (0.40) ALDH1A1TDP1LMNAPOLBRECQL
Lithium Ion SCHEMBL8677043 0.74 GPR84 (0.46) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL2399155 0.74 ALDH1A1 (0.37) ALDH1A1TDP1LMNAPOLBRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111943825-A Method for synthesizing dihydrojasmone under acidic condition 万香科技股份有限公司 2020-11-17 CN claimed
CN-111848373-A Method for synthesizing dihydrojasmone under alkaline condition 万香科技股份有限公司 2020-10-30 CN claimed
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-113185392-A Synthesis method of dihydro jasmone 安徽华业香料合肥有限公司 2021-07-30 CN disclosed
CN-111943825-A Method for synthesizing dihydrojasmone under acidic condition 万香科技股份有限公司 2020-11-17 CN disclosed
CN-111943825-A Method for synthesizing dihydrojasmone under acidic condition 万香科技股份有限公司 2020-11-17 CN disclosed
CN-111848373-A Method for synthesizing dihydrojasmone under alkaline condition 万香科技股份有限公司 2020-10-30 CN disclosed
CN-111848373-A Method for synthesizing dihydrojasmone under alkaline condition 万香科技股份有限公司 2020-10-30 CN disclosed