SCHEMBL28306901

SCHEMBL28306901

CC(=O)OC(=O)OC(C)=O.[CaH2].[CaH2].[NaH].[NaH]

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
TSHR P16473 3/20 0.60
HSD17B10 Q99714 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
LMNA P02545 3/20 0.33
KDM4E B2RXH2 1/20 0.33
CA2 P00918 1/20 0.33
PTGS1 P23219 1/20 0.33
MMP12 P39900 1/20 0.33
SOAT1 P35610 1/20 0.32
NFKB1 P19838 1/20 0.32
THPO P40225 1/20 0.31
FFAR3 O14843 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 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
SCHEMBL9806977 0.96 ALDH1A1 (0.64) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL1844531 0.96 ALDH1A1 (0.64) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL11482159 0.96 ALDH1A1 (0.64) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL16431964 0.93 ALDH1A1 (0.60) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL993741 0.93 ALDH1A1 (0.69) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL10704274 0.90 ALDH1A1 (0.56) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL6363153 0.89 ALDH1A1 (0.64) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL2856429 0.89 ALDH1A1 (0.64) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL29084539 0.89 ALDH1A1 (0.64) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL4100191 0.89 ALDH1A1 (0.64) ALDH1A1TSHRHSD17B10TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110055159-B Production equipment and method of microecologics for pet intestinal health care 青岛农业大学 2022-07-26 CN disclosed
CN-110055159-A A kind of production equipment and method of pet enteron aisle probiotics for health care 青岛农业大学 2019-07-26 CN disclosed