SCHEMBL6549622

SCHEMBL6549622

CCCCCC(=O)C[S+]1CCCC1.CCCCS(=O)(=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.36
CES1 P23141 4/20 0.36
HAO1 Q9UJM8 1/20 0.36
EPHX2 P34913 1/20 0.35
KMT2A Q03164 3/20 0.35
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
TDP1 Q9NUW8 3/20 0.32
MEN1 O00255 2/20 0.32
AKR1B1 P15121 1/20 0.32
PPARG P37231 4/20 0.31
PPARD Q03181 4/20 0.31
PPARA Q07869 4/20 0.31
TSHR P16473 3/20 0.31
GPR84 Q9NQS5 3/20 0.31
HDAC11 Q96DB2 3/20 0.31
ALDH1A1 P00352 2/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
SLC22A8 Q8TCC7 1/20 0.31
TLR2 O60603 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
SCHEMBL6551036 0.99 HAO1 (0.38) CES2CES1HAO1EPHX2KMT2A
SCHEMBL6550637 0.99 CES2 (0.35) CES2CES1HAO1EPHX2KMT2A
SCHEMBL6550505 0.97 HAO1 (0.37) CES2CES1HAO1EPHX2KMT2A
SCHEMBL6550408 0.95 CES1 (0.34) CES2CES1HAO1EPHX2MAPT
SCHEMBL6551534 0.94 CES1 (0.33) CES2CES1EPHX2
SCHEMBL6548781 0.93 EPHX2 (0.33) CES2CES1EPHX2MAPTALDH1A1
SCHEMBL6551406 0.91 EPHX2 (0.33) EPHX2
SCHEMBL6550551 0.88 EPHX2 (0.34) EPHX2MAPTALDH1A1HSD17B10
SCHEMBL7160664 0.87 EPHX2 (0.36) CES2CES1HAO1EPHX2KMT2A
SCHEMBL7164340 0.87 CES2 (0.33) CES2CES1HAO1EPHX2KMT2A

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