SCHEMBL4916547

SCHEMBL4916547

C=C(C)C(=O)OCCCCCC(=O)NCCOC(=O)C(=C)C

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
HTT P42858 2/20 0.44
POLB P06746 1/20 0.44
APEX1 P27695 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
THRB P10828 1/20 0.42
FAAH O00519 3/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LPAR1 Q92633 2/20 0.39
LPAR2 Q9HBW0 2/20 0.39
ENPP2 Q13822 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
DNM1 Q05193 1/20 0.38
ACHE P22303 5/20 0.38

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
SCHEMBL4915028 0.98 TSHR (0.54) TSHRHTTPOLBAPEX1TDP1
SCHEMBL16425936 0.97 TSHR (0.51) TSHRHTTPOLBAPEX1TDP1
SCHEMBL4918092 0.93 TSHR (0.51) TSHRHTTPOLBAPEX1TDP1
SCHEMBL24099523 0.92 TSHR (0.50) TSHRHTTPOLBAPEX1TDP1
SCHEMBL17830827 0.91 TSHR (0.63) TSHRFAAHLPAR1LPAR2ENPP2
SCHEMBL16309297 0.90 TSHR (0.53) TSHRHTTPOLBAPEX1TDP1
SCHEMBL16309307 0.88 THRB (0.48) TSHRHTTPOLBAPEX1TDP1
SCHEMBL2612452 0.87 TSHR (0.62) TSHRHTTPOLBAPEX1TDP1
SCHEMBL16309329 0.87 TSHR (0.58) TSHRHTTPOLBAPEX1TDP1
SCHEMBL4917590 0.86 THRB (0.47) TSHRHTTPOLBAPEX1TDP1

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-20080102262-A1 Radiation Curable Composition and Curing Product Thereof, and Laminate Including the Same MITSUBISHI CHEMICAL CORPORATION (JP) 2008-05-01 US disclosed