SCHEMBL643415

SCHEMBL643415

C=CC(=O)OC(CC)COCCOCC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 5/20 0.40
TP53 P04637 2/20 0.40
HIF1A Q16665 2/20 0.40
HSD17B10 Q99714 1/20 0.40
THRB P10828 2/20 0.38
CTSK P43235 1/20 0.33
CYP3A4 P08684 1/20 0.32
PLA2G2C Q5R387 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
SCHEMBL2910849 0.87 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL202720 0.87 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28584448 0.84 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL18123487 0.82 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL561301 0.80 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28489811 0.80 TSHR (0.41) TSHRHPGDALDH1A1TP53HIF1A
Diethylene Glycol Monoethyl Ether SCHEMBL1618201 0.79 THRB (0.41) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1537104 0.79 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27963577 0.79 TSHR (0.40) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL18116697 0.78 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119749-B2 Method of taking (meth)acrylic ester polymer out of liquid reaction mixture KURARAY CO., LTD. (JP) 2012-02-21 US disclosed
US-20090118450-A1 METHOD OF TAKING (METH)ACRYLIC ESTER POLYMER OUT OF LIQUID REACTION MIXTURE KURARAY CO., LTD. (JP) 2009-05-07 US disclosed
EP-1916262-A1 METHOD OF TAKING (METH)ACRYLIC ESTER POLYMER OUT OF LIQUID REACTION MIXTURE Kuraray Co., Ltd. (JP) 2008-04-30 EP disclosed