SCHEMBL6551222

SCHEMBL6551222

CC[S+](CC)CC(=O)C(C)C.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.39

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 1/20 0.39
MAPK1 P28482 1/20 0.39
THPO P40225 1/20 0.39
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MDM2 Q00987 1/20 0.37
ALDH1A1 P00352 5/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
CA2 P00918 3/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
GAA P10253 3/20 0.35
GBA1 P04062 1/20 0.35
CA1 P00915 2/20 0.34
MMP1 P03956 2/20 0.34
MMP2 P08253 2/20 0.34
MMP9 P14780 2/20 0.34

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
SCHEMBL6550585 0.86 ALDH1A1 (0.39) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL6549303 0.85 ALDH1A1 (0.39) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL6550573 0.84 ALDH1A1 (0.38) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL6551304 0.83 ALDH1A1 (0.40) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL6549549 0.82 ALDH1A1 (0.39) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL926758 0.81 GAA (0.48) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL6550458 0.80 ALDH1A1 (0.42) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL6551397 0.79 ALDH1A1 (0.41) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL6551160 0.79 ALDH1A1 (0.37) LMNACYP3A4CYP2D6MAPK1THPO
SCHEMBL6551402 0.77 ALDH1A1 (0.41) LMNACYP3A4CYP2D6MAPK1THPO

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 5 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-20040224251-A1 Positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-11 US 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