SCHEMBL17119709

SCHEMBL17119709

C=CC(=O)OCCOC(=O)CCC(=O)OCCOC(=O)CCC(=O)OCCOC(=O)C=C

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.67
ALDH1A1 P00352 4/20 0.67
TP53 P04637 3/20 0.67
HIF1A Q16665 3/20 0.67
HSD17B10 Q99714 1/20 0.67
CYP3A4 P08684 2/20 0.60
HPGD P15428 1/20 0.54
THRB P10828 3/20 0.53
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA1A P35348 1/20 0.43
MAPT P10636 1/20 0.41
BLM P54132 1/20 0.41
DGKA P23743 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
HTR2C P28335 1/20 0.32
ATM Q13315 1/20 0.32
APP P05067 1/20 0.32

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
SCHEMBL303596 1.00 TSHR (0.67) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL28959488 0.94 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL2459290 0.93 TSHR (0.64) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL9143157 0.93 TSHR (0.64) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL25823302 0.92 TSHR (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
Succinic Acid SCHEMBL30527931 0.92 TSHR (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4197617 0.92 TSHR (0.76) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL26622823 0.92 TSHR (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL33640 0.92 TSHR (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL1151178 0.91 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10

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-20150267196-A1 BIODEGRADABLE HYDROGEL FOR POLYNUCLEOTIDE DELIVERY UNIV CASE WESTERN RESERVE (US) 2015-09-24 US disclosed