SCHEMBL7164791

SCHEMBL7164791

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

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.37
PRKCA P17252 1/20 0.33
HAO1 Q9UJM8 1/20 0.32
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
CES2 O00748 3/20 0.31
CES1 P23141 3/20 0.31
THRA P10827 1/20 0.31
THRB P10828 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
SCHEMBL7162219 0.97 EPHX2 (0.37) EPHX2PRKCAHAO1MAPTKMT2A
SCHEMBL7163703 0.97 EPHX2 (0.37) EPHX2PRKCAHAO1MAPTKMT2A
SCHEMBL7161796 0.95 EPHX2 (0.37) EPHX2PRKCACES2CES1THRA
SCHEMBL7157300 0.95 HAO1 (0.35) EPHX2HAO1MAPTKMT2ACES2
SCHEMBL7157246 0.95 EPHX2 (0.31) EPHX2CES2CES1
SCHEMBL7157579 0.94 EPHX2 (0.33) EPHX2HAO1MAPTKMT2ACES2
SCHEMBL7162769 0.91 EPHX2 (0.38) EPHX2PRKCACES2CES1
SCHEMBL7157241 0.90 EPHX2 (0.31) EPHX2
SCHEMBL7160768 0.87 EPHX2 (0.39) EPHX2PRKCACES2CES1THRA
SCHEMBL7160151 0.85 EPHX2 (0.32) 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