SCHEMBL7160768

SCHEMBL7160768

CC(=O)C[S+]1CCC(=O)CC1.CCCCCCCCS(=O)(=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.39
PRKCA P17252 1/20 0.34
THRB P10828 3/20 0.32
THRA P10827 1/20 0.32
RECQL P46063 2/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
BLM P54132 1/20 0.31
FAAH O00519 5/20 0.31
CES2 O00748 2/20 0.31
CES1 P23141 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
SCHEMBL7161517 0.94 EPHX2 (0.32) EPHX2
SCHEMBL7162769 0.88 EPHX2 (0.38) EPHX2PRKCAFAAHCES2CES1
SCHEMBL7164791 0.87 EPHX2 (0.37) EPHX2PRKCATHRBTHRACES2
SCHEMBL7162219 0.87 EPHX2 (0.37) EPHX2PRKCATHRBTHRACES2
SCHEMBL7163703 0.87 EPHX2 (0.37) EPHX2PRKCATHRBTHRACES2
SCHEMBL7161796 0.87 EPHX2 (0.37) EPHX2PRKCATHRBTHRAFAAH
SCHEMBL7157300 0.84 HAO1 (0.35) EPHX2CES2CES1
SCHEMBL7157579 0.83 EPHX2 (0.33) EPHX2CES2CES1
SCHEMBL7161521 0.82 EPHX2 (0.39) EPHX2THRBRECQLGLAHPGD
SCHEMBL7158438 0.82 EPHX2 (0.42) EPHX2THRBTHRARECQLGLA

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-6548220-B2 Containing acid generator SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-15 US disclosed