SCHEMBL13864091

SCHEMBL13864091

CC(=O)OC(C)(C)CCOCC1CO1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 6/20 0.41
TDP1 Q9NUW8 1/20 0.41
TP53 P04637 3/20 0.37
CYP3A4 P08684 1/20 0.37
GAA P10253 1/20 0.35
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
PPARG P37231 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL13864102 0.91 TSHR (0.50) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL14473385 0.86 TSHR (0.43) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL14473466 0.86 TSHR (0.43) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL13864092 0.86 TSHR (0.43) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL13864105 0.85 TSHR (0.58) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL14473529 0.81 TSHR (0.39) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL13864093 0.81 TSHR (0.39) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL13864106 0.80 GAA (0.44) TSHRMAPK1ALDH1A1TP53CYP3A4
SCHEMBL13864095 0.79 TSHR (0.38) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1
SCHEMBL14473540 0.79 TSHR (0.37) TSHRMAPK1SMN1; SMN2ALDH1A1TDP1

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
US-20090137777-A1 Polyepoxy compound, method for producing same, thermosetting resin composition containing same, cured product of such composition, and method for removing such cured product KANSAI PAINT CO., LTD. (JP) 2009-05-28 US disclosed
EP-1803758-A1 POLYEPOXY COMPOUND, METHOD FOR PRODUCING SAME, THERMOSETTING RESIN COMPOSITION CONTAINING SAME, CURED PRODUCT OF SUCH COMPOSITION, AND METHOD FOR REMOVING SUCH CURED PRODUCT KANSAI PAINT CO., LTD. (JP) 2007-07-04 EP disclosed