SCHEMBL13704261

SCHEMBL13704261

CCC(C)C(=O)OCC(=O)OC(C)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.46
L3MBTL1 Q9Y468 4/20 0.41
HTT P42858 2/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
KLK7 P49862 1/20 0.40
ALDH1A1 P00352 1/20 0.40
FFAR1 O14842 1/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
LMNA P02545 3/20 0.40
POLB P06746 1/20 0.40
LPAR1 Q92633 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL872787 0.87 HCAR2 (0.51) HCAR2MAPTKLK7ALDH1A1FFAR1
SCHEMBL13704250 0.85 ALDH1A1 (0.34) HCAR2MAPTKDM4EALDH1A1FFAR1
SCHEMBL13704265 0.83 UGT2B7 (0.43) MEN1KMT2ATSHR
SCHEMBL13704308 0.83 GPR139 (0.36) HCAR2L3MBTL1HTTMAPTKDM4E
SCHEMBL13704315 0.82 CYP2D6 (0.39) L3MBTL1TDP1
SCHEMBL13704311 0.82 CYP2D6 (0.39) L3MBTL1TDP1
SCHEMBL13704274 0.82 CYP2D6 (0.39) L3MBTL1TDP1
SCHEMBL13704302 0.81 ALOX5 (0.42) L3MBTL1HTTMAPTALDH1A1LMNA
SCHEMBL1766133 0.80 TSHR (0.51) HCAR2MAPTKDM4EALDH1A1FFAR1
SCHEMBL13704253 0.80 SMN1; SMN2 (0.39) L3MBTL1HTTKDM4EKMT2APOLB

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-20090226822-A1 RECORDING MEDIUM KABUSHIKI KAISHA TOSHIBA 2009-09-10 US disclosed