SCHEMBL4918092

SCHEMBL4918092

C=C(C)C(=O)OCCCC(=O)NCCOC(=O)C(=C)C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.51
THRB P10828 1/20 0.44
HTT P42858 2/20 0.40
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 2/20 0.38
HPGD P15428 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CNR1 P21554 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
RECQL P46063 1/20 0.35
FAAH O00519 2/20 0.35
GAA P10253 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35

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 0.95 TSHR (0.54) TSHRTHRBHTTPOLBAPEX1
SCHEMBL24099523 0.95 TSHR (0.50) TSHRTHRBHTTPOLBAPEX1
SCHEMBL4916547 0.93 TSHR (0.57) TSHRTHRBHTTPOLBAPEX1
SCHEMBL16425936 0.93 TSHR (0.51) TSHRTHRBHTTPOLBAPEX1
SCHEMBL16309307 0.91 THRB (0.48) TSHRTHRBHTTPOLBAPEX1
SCHEMBL15693952 0.91 TSHR (0.44) TSHRTHRBHTTPOLBAPEX1
SCHEMBL16309297 0.90 TSHR (0.53) TSHRTHRBHTTPOLBAPEX1
SCHEMBL16309329 0.90 TSHR (0.58) TSHRTHRBHTTPOLBAPEX1
SCHEMBL4917590 0.89 THRB (0.47) TSHRTHRBHTTPOLBAPEX1
SCHEMBL8438170 0.89 TSHR (0.45) TSHRTHRBHTTPOLBAPEX1

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