SCHEMBL2319664

SCHEMBL2319664

CCOC(=O)C(=O)C(=O)CCl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GLO1 Q04760 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
TSHR P16473 1/20 0.39
ALOX15 P16050 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
SOAT1 P35610 1/20 0.39
EGLN1 Q9GZT9 1/20 0.38
MAPT P10636 1/20 0.36
TRPA1 O75762 1/20 0.36
CYP2D6 P10635 1/20 0.35
FAAH O00519 2/20 0.35

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
SCHEMBL1298514 0.85
SCHEMBL2821588 0.80 SOAT1 (0.48) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL1418707 0.79 ALDH1A1 (0.56) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL247694 0.79 ALDH1A1 (0.56) ALDH1A1LMNAHSD17B10NPSR1GLO1
Water SCHEMBL27569536 0.78 SOAT1 (0.46) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL14934920 0.77 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL18979198 0.76 ALDH1A1 (0.53) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL29896398 0.76 ALDH1A1 (0.53) ALDH1A1LMNAHSD17B10NPSR1GLO1
Water SCHEMBL1097795 0.76 ALDH1A1 (0.53) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL8630186 0.76 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10NPSR1GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130029378-A1 NOVEL ENZYME ISIS INNOVATION LIMITED (GB) 2013-01-31 US disclosed
EP-2356226-A2 NOVEL ENZYME ISIS INNOVATION LIMITED (GB) 2011-08-17 EP disclosed
WO-2010041055-A2 NOVEL ENZYME ISIS INNOVATION LIMITED (GB) 2010-04-15 WO disclosed
US-20100086958-A1 NOVEL ENZYME ISIS INNOVATION LIMITED (GB) 2010-04-08 US disclosed