SCHEMBL6958990

SCHEMBL6958990

CCOC(=O)NC(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
ALDH1A1 P00352 4/20 0.46
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALOX15 P16050 1/20 0.42
SOAT1 P35610 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
TRPA1 O75762 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL7713280 0.92 GAA (0.55) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL6468449 0.84 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28695942 0.82
SCHEMBL697911 0.81
SCHEMBL944132 0.81 GAA (0.50) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL6958983 0.80 GAA (0.44) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL862169 0.80
SCHEMBL6959622 0.79
SCHEMBL1413000 0.79 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL2105768 0.79

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
CN-1227501-A Long-acting drugs and pharmaceutical compositions comprising them YEDA RES & DEV (IL) 1999-09-01 CN disclosed