SCHEMBL6551277

SCHEMBL6551277

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

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.36
BBOX1 O75936 2/20 0.34
GMNN O75496 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
THPO P40225 1/20 0.31
HBB P68871 1/20 0.31
PMP22 Q01453 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
TDP1 Q9NUW8 1/20 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
SCHEMBL6550658 0.88 CES1 (0.38) EPHX2BBOX1GMNNALDH1A1LMNA
SCHEMBL6550939 0.88 EPHX2 (0.35) EPHX2BBOX1GMNNALDH1A1LMNA
SCHEMBL6550710 0.88 EPHX2 (0.35) EPHX2BBOX1GMNNALDH1A1LMNA
SCHEMBL6549356 0.87 CES2 (0.39) EPHX2ALDH1A1TSHRCES2CES1
SCHEMBL6549340 0.85 CES2 (0.41) EPHX2ALDH1A1TSHRCES2CES1
SCHEMBL6549430 0.84 EPHX2 (0.37) EPHX2BBOX1GMNNALDH1A1LMNA
SCHEMBL6550608 0.84 EPHX2 (0.37) EPHX2BBOX1GMNNALDH1A1LMNA
SCHEMBL6550441 0.80 EPHX2 (0.35) EPHX2BBOX1LMNACES2CES1
SCHEMBL6550446 0.80 EPHX2 (0.35) EPHX2BBOX1
SCHEMBL6551163 0.80 EPHX2 (0.35) EPHX2BBOX1

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