SCHEMBL7184472

SCHEMBL7184472

CC(O)OCC(O)COCCO

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
USP2 O75604 1/20 0.38
TSHR P16473 2/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HTT P42858 2/20 0.33
LPAR5 Q9H1C0 1/20 0.33
SPHK1 Q9NYA1 1/20 0.31
KDM4E B2RXH2 1/20 0.30
THRB P10828 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL6437383 0.86 USP2 (0.47) HSD17B10TDP1USP2TSHRMEN1
SCHEMBL350840 0.83 TSHR (0.53) HSD17B10TDP1USP2TSHRMAPK1
SCHEMBL489075 0.81 NR2E1 (0.33) HSD17B10TDP1TSHRMAPK1ALDH1A1
SCHEMBL12363491 0.80 HSD17B10 (0.43) HSD17B10TDP1USP2TSHRMAPK1
SCHEMBL16265139 0.80 HSD17B10 (0.60) HSD17B10TDP1USP2TSHRMAPK1
SCHEMBL10712246 0.79 TSHR (0.43) HSD17B10TDP1USP2TSHRMAPK1
SCHEMBL5021533 0.79 MEN1 (0.61) HSD17B10TDP1USP2TSHRMAPK1
SCHEMBL18251584 0.79 MEN1 (0.61) HSD17B10TDP1USP2TSHRMAPK1
SCHEMBL3542017 0.79 MEN1 (0.61) HSD17B10TDP1USP2TSHRMAPK1
SCHEMBL19865101 0.78 HSD17B10 (0.38) HSD17B10TDP1USP2TSHRMAPK1

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-6586106-B2 Ink transfer, adhesion and aging stability, and being satisfactory in back ghost when offset printing using oxidation polymerization type ink is performed on both faces YUPO CORPORATION (JP) 2003-07-01 US disclosed