SCHEMBL10010418

SCHEMBL10010418

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.39
ALDH1A1 P00352 6/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 1/20 0.34
ALOX15 P16050 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
CYP2C9 P11712 1/20 0.33
SOAT1 P35610 1/20 0.33
MMP8 P22894 1/20 0.33
KDM4E B2RXH2 2/20 0.32
PKM P14618 2/20 0.32
CYP2D6 P10635 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL10010421 1.00 GLO1 (0.39) GLO1ALDH1A1LMNAHSD17B10MAPT
SCHEMBL10009232 0.87 ALDH1A1 (0.42) GLO1ALDH1A1LMNAHSD17B10MAPT
SCHEMBL10009228 0.87 ALDH1A1 (0.42) GLO1ALDH1A1LMNAHSD17B10MAPT
SCHEMBL10010078 0.85 RAB9A (0.38) ALDH1A1LMNATSHRGAAKDM4E
SCHEMBL10010077 0.85 RAB9A (0.38) ALDH1A1LMNATSHRGAAKDM4E
SCHEMBL10008115 0.82 ALDH1A1 (0.47) ALDH1A1LMNANPSR1TSHRCYP2C9
SCHEMBL10008119 0.82 ALDH1A1 (0.47) ALDH1A1LMNANPSR1TSHRCYP2C9
SCHEMBL10009994 0.82 SOAT1 (0.39) GLO1ALDH1A1LMNAHSD17B10MAPT
SCHEMBL10009989 0.82 SOAT1 (0.39) GLO1ALDH1A1LMNAHSD17B10MAPT
SCHEMBL10008745 0.79 TSHR (0.48) ALDH1A1TSHRGAAMMP8KDM4E

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