SCHEMBL27366967

SCHEMBL27366967

CCOCCCC(=O)OC(=O)CC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
GAA P10253 2/20 0.40
MGAM O43451 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
TSHR P16473 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
CES2 O00748 1/20 0.36
THRB P10828 1/20 0.35
EPHX2 P34913 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 2/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
DGKA P23743 1/20 0.33
CYP1A2 P05177 1/20 0.33
TP53 P04637 1/20 0.33

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
Methacrylic Acid SCHEMBL27298386 0.91 THRB (0.40) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL249490 0.88 ALDH1A1 (0.50) ALDH1A1TSHRSMN1; SMN2CES2THRB
SCHEMBL27291781 0.84 ALDH1A1 (0.46) ALDH1A1TSHRSMN1; SMN2THRBEPHX2
SCHEMBL27273693 0.82 ALDH1A1 (0.48) ALDH1A1TSHRSMN1; SMN2CES2THRB
SCHEMBL27298076 0.82 ALDH1A1 (0.50) ALDH1A1TSHRCES2DGKATP53
SCHEMBL11552370 0.82 ALDH1A1 (0.62) ALDH1A1TSHRSMN1; SMN2CES2THRB
SCHEMBL27316978 0.81 DGKA (0.53) ALDH1A1TSHRCES2DGKA
SCHEMBL11616036 0.80 DGKA (0.47) ALDH1A1TSHRCES2EPHX2DGKA
SCHEMBL27361449 0.79 TSHR (0.41) ALDH1A1TSHRSMN1; SMN2EPHX2HPGD
SCHEMBL28172278 0.79 ALDH1A1 (0.50) ALDH1A1GAAMGAMSIMGAM2

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
CN-101687945-B Crosslinkable polymer dispersions, coating compositions comprising them and use thereof CELANESE EMULSIONS GMBH 2012-07-04 CN disclosed
CN-101687945-A Crosslinkable polymer dispersions, coating compositions comprising them and use thereof CELANESE EMULSIONS GMBH 2010-03-31 CN disclosed
CN-1054612-C Aqueous polymer dispersion BASF AG (DE) 2000-07-19 CN disclosed
CN-1078478-A Aqueous polymer dispersion BASF AG (DE) 1993-11-17 CN disclosed