SCHEMBL7157246

SCHEMBL7157246

CCCCC(=O)C[S+]1CCC(=O)CC1.CCCCS(=O)(=O)[O-]

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.31
CES2 O00748 1/20 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
SCHEMBL7157579 0.96 EPHX2 (0.33) EPHX2CES2CES1
SCHEMBL7157300 0.95 HAO1 (0.35) EPHX2CES2CES1
SCHEMBL7164791 0.95 EPHX2 (0.37) EPHX2CES2CES1
SCHEMBL7157241 0.95 EPHX2 (0.31) EPHX2
SCHEMBL7162219 0.92 EPHX2 (0.37) EPHX2CES2CES1
SCHEMBL7163703 0.92 EPHX2 (0.37) EPHX2CES2CES1
SCHEMBL7160151 0.90 EPHX2 (0.32) EPHX2
SCHEMBL7161796 0.90 EPHX2 (0.37) EPHX2CES2CES1
SCHEMBL6726127 0.87 CES1 (0.35) CES2CES1
SCHEMBL7159622 0.86 EPHX2 (0.31) EPHX2

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