SCHEMBL3360217

SCHEMBL3360217

C=C(C=CC(=O)O)C(=O)OCC.C=CC(=O)OCCCC.C=CC(=O)OCCO

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.55
HPGD P15428 1/20 0.55
HCAR2 Q8TDS4 5/20 0.52
ATM Q13315 1/20 0.43
ALDH1A1 P00352 4/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
THRB P10828 1/20 0.33
ACHE P22303 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
Acrylic Acid Ethyl Ester SCHEMBL3421934 0.96 TSHR (0.54) TSHRHPGDHCAR2ATMALDH1A1
SCHEMBL2778233 0.95 TSHR (0.58) TSHRHPGDHCAR2ATMALDH1A1
SCHEMBL5859055 0.95 TSHR (0.58) TSHRHPGDHCAR2ATMALDH1A1
SCHEMBL3361083 0.95 TSHR (0.61) TSHRHPGDHCAR2ATMALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL2032729 0.90 TSHR (0.57) TSHRHPGDHCAR2ATMALDH1A1
SCHEMBL11513248 0.87 TSHR (0.49) TSHRHPGDHCAR2ATMALDH1A1
SCHEMBL8424813 0.84 TSHR (0.46) TSHRHPGDHCAR2ATMALDH1A1
Styrene SCHEMBL11254198 0.84 TSHR (0.46) TSHRHPGDHCAR2ATMALDH1A1
SCHEMBL6915106 0.84 TSHR (0.57) TSHRHPGDHCAR2ATMALDH1A1
SCHEMBL887886 0.84 TSHR (0.61) TSHRHPGDHCAR2ATMALDH1A1

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-20100252185-A1 REMOVABLE PRESSURE SENSITIVE ADHESIVE SHEET AND METHOD FOR PROCESSING ADHEREND USING THE SAME NITTO DENKO CORPORATION (JP) 2010-10-07 US disclosed
US-20100215882-A1 HEAT-PEELABLE PRESSURE-SENSITIVE ADHESIVE SHEET FOR CUTTING LAMINATED CERAMIC SHEET AND METHOD FOR CUT-PROCESSING LAMINATED CERAMIC SHEET NITTO DENKO CORPORATION (JP) 2010-08-26 US disclosed