SCHEMBL7159846

SCHEMBL7159846

CCCCC(=O)C[S+]1CCSCC1.CCCCCCCCS(=O)(=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.40
HAO1 Q9UJM8 1/20 0.33
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
CES2 O00748 6/20 0.32
CES1 P23141 5/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
FAAH O00519 5/20 0.30

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
SCHEMBL7159565 0.97 EPHX2 (0.40) EPHX2HAO1MAPTKMT2ACES2
SCHEMBL7159920 0.97 EPHX2 (0.40) EPHX2HAO1MAPTKMT2ACES2
SCHEMBL7163659 0.95 EPHX2 (0.38) EPHX2HAO1MAPTKMT2ACES2
SCHEMBL7162247 0.95 EPHX2 (0.40) EPHX2CES2CES1THRATHRB
SCHEMBL7157272 0.95 EPHX2 (0.34) EPHX2CES2CES1
SCHEMBL7160664 0.93 EPHX2 (0.36) EPHX2HAO1MAPTKMT2ACES2
SCHEMBL7157244 0.91 EPHX2 (0.41) EPHX2CES2CES1FAAH
SCHEMBL7159591 0.89 EPHX2 (0.34) EPHX2
SCHEMBL7158435 0.87 EPHX2 (0.40) EPHX2CES2CES1FAAH
SCHEMBL7158438 0.86 EPHX2 (0.42) EPHX2CES2CES1THRATHRB

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