SCHEMBL10009989

SCHEMBL10009989

CCOC(=O)/C(CC)=C(/CC(C)(C)C)C(=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.39
ALDH1A1 P00352 6/20 0.37
NPSR1 Q6W5P4 2/20 0.36
GLO1 Q04760 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TSHR P16473 1/20 0.35
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
MAPT P10636 1/20 0.33
MMP8 P22894 1/20 0.33
CYP2D6 P10635 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TRPA1 O75762 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 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
SCHEMBL10009994 1.00 SOAT1 (0.39) SOAT1ALDH1A1NPSR1GLO1LMNA
SCHEMBL10009228 0.94 ALDH1A1 (0.42) SOAT1ALDH1A1NPSR1GLO1LMNA
SCHEMBL10009232 0.94 ALDH1A1 (0.42) SOAT1ALDH1A1NPSR1GLO1LMNA
SCHEMBL304712 0.84 SOAT1 (0.52) SOAT1ALDH1A1NPSR1GLO1LMNA
SCHEMBL11146140 0.84 SOAT1 (0.52) SOAT1ALDH1A1NPSR1GLO1LMNA
SCHEMBL304714 0.84 SOAT1 (0.52) SOAT1ALDH1A1NPSR1GLO1LMNA
SCHEMBL10009675 0.84 RAB9A (0.39) ALDH1A1LMNATSHRGAASMN1; SMN2
SCHEMBL10009680 0.84 RAB9A (0.39) ALDH1A1LMNATSHRGAASMN1; SMN2
SCHEMBL10008951 0.84 ALDH1A1 (0.34) SOAT1ALDH1A1NPSR1GLO1LMNA
SCHEMBL10008952 0.84 ALDH1A1 (0.34) SOAT1ALDH1A1NPSR1GLO1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120172551-A1 SOLID CATALYST FOR PROPYLENE POLYMERIZATION AND A METHOD FOR PREPARATION OF POLYPROPYLENE USING THE SAME SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2012-07-05 US disclosed