SCHEMBL29115657

SCHEMBL29115657

CC(CC(=O)O)OC(=O)C(C)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.40
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
GABRR1 P24046 2/20 0.34
LMNA P02545 2/20 0.34
CACNA2D1 P54289 2/20 0.33
CACNB3 P54284 1/20 0.33
CACNA1C Q13936 1/20 0.33
PGR P06401 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
CACNA2D2 Q9NY47 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GPR84 Q9NQS5 2/20 0.32
PGD P52209 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 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
SCHEMBL29124667 0.86 SLC22A6 (0.40) SLC22A6SMN1; SMN2MAPTALOX15GABRR1
SCHEMBL27637701 0.80 GABRP (0.37) SLC22A6SMN1; SMN2MAPTALOX15GABRR1
SCHEMBL29124638 0.79 SMN1; SMN2 (0.37) SLC22A6SMN1; SMN2MAPTALOX15GABRR1
SCHEMBL28445647 0.78 BHMT (0.37) SLC22A6ALOX15GABRR1LMNACACNA2D1
SCHEMBL13645090 0.78 MAPT (0.35) SLC22A6SMN1; SMN2MAPTALOX15LMNA
SCHEMBL28445648 0.78 BHMT (0.37) SLC22A6ALOX15GABRR1LMNACACNA2D1
SCHEMBL726981 0.78 TP53 (0.40) SLC22A6TP53SMN1; SMN2MAPTALOX15
SCHEMBL10592101 0.78 MAPT (0.35) SLC22A6SMN1; SMN2MAPTALOX15LMNA
SCHEMBL1268762 0.78 SLC22A6 (0.39) SLC22A6SMN1; SMN2MAPTALOX15GABRR1
SCHEMBL7036253 0.77 ALOX15 (0.35) SLC22A6SMN1; SMN2MAPTALOX15GABRR1

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-117305212-A Genetically engineered bacterium for producing poly (3-hydroxybutyrate) lactate and application thereof 华东理工大学 2023-12-29 CN claimed
CN-116855431-A Coli genetic engineering bacteria for producing poly 3-hydroxybutyrate lactate and application thereof 华东理工大学 2023-10-10 CN claimed
CN-117305212-A Genetically engineered bacterium for producing poly (3-hydroxybutyrate) lactate and application thereof 华东理工大学 2023-12-29 CN disclosed
CN-117305212-A Genetically engineered bacterium for producing poly (3-hydroxybutyrate) lactate and application thereof 华东理工大学 2023-12-29 CN disclosed
CN-116917264-A Process for preparing hydroxybutyric acid carboxylic ester 凯托利皮克斯治疗有限责任公司 2023-10-20 CN disclosed
CN-116855431-A Coli genetic engineering bacteria for producing poly 3-hydroxybutyrate lactate and application thereof 华东理工大学 2023-10-10 CN disclosed
CN-116855431-A Coli genetic engineering bacteria for producing poly 3-hydroxybutyrate lactate and application thereof 华东理工大学 2023-10-10 CN disclosed
CN-116855431-A Coli genetic engineering bacteria for producing poly 3-hydroxybutyrate lactate and application thereof 华东理工大学 2023-10-10 CN disclosed