SCHEMBL6550576

SCHEMBL6550576

CCCCCCC(=O)C[S+](C)C(C)(C)C.CCCCS(=O)(=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 1/20 0.38
CES2 O00748 5/20 0.38
CES1 P23141 5/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 1/20 0.38
EPHX2 P34913 1/20 0.37
MEN1 O00255 2/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
GRK2 P25098 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PPARG P37231 6/20 0.33
PPARD Q03181 6/20 0.33
PPARA Q07869 6/20 0.33
HDAC11 Q96DB2 5/20 0.33
TSHR P16473 4/20 0.33
GPR84 Q9NQS5 4/20 0.33
ALDH1A1 P00352 2/20 0.33
TLR2 O60603 2/20 0.33
TDP1 Q9NUW8 2/20 0.33

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
SCHEMBL6548750 0.99 CES1 (0.36) HAO1CES2CES1KMT2AMAPT
SCHEMBL6549512 0.94 CES1 (0.34) HAO1CES2CES1KMT2AEPHX2
SCHEMBL6550895 0.91 EPHX2 (0.33) CES2CES1KMT2AEPHX2MEN1
SCHEMBL6551035 0.87 EPHX2 (0.34) KMT2AEPHX2MEN1LMNAPOLB
SCHEMBL6723095 0.86 KMT2A (0.48) HAO1CES2CES1KMT2AMAPT
Trifluoromethanesulfonic Acid SCHEMBL6550918 0.86 CES1 (0.40) HAO1CES2CES1KMT2AMAPT
SCHEMBL6549243 0.85 CES2 (0.42) HAO1CES2CES1KMT2AMAPT
SCHEMBL6725787 0.84 KMT2A (0.45) HAO1CES2CES1KMT2AMAPT
Trifluoromethanesulfonic Acid SCHEMBL6550483 0.84 FAAH (0.39) HAO1CES2CES1KMT2AMEN1
SCHEMBL6551502 0.83 CES2 (0.41) HAO1CES2CES1KMT2AMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1167349-B1 Chemical amplifying type positive resist composition SUMITOMO CHEMICAL CO (JP) 2004-12-01 EP disclosed
US-6548220-B2 Containing acid generator SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-15 US disclosed
US-20020015913-A1 Chemical amplifying type positive resist composition and sulfonium salt SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-07 US disclosed
EP-1167349-A1 Chemical amplifying type positive resist composition and sulfonium salt SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-02 EP disclosed