SCHEMBL5850133

SCHEMBL5850133

COc1ccccc1[S+](c1ccccc1)c1ccccc1.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.44

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
KMT2A Q03164 3/20 0.40
HTR6 P50406 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
HTT P42858 3/20 0.39
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
GAA P10253 3/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.36
VDR P11473 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL6855470 0.93 HTR6 (0.42) KMT2AHTR6SMN1; SMN2HTTMAPT
SCHEMBL6850300 0.93 SMN1; SMN2 (0.39) KMT2AHTR6SMN1; SMN2HTTMAPT
SCHEMBL5851079 0.93 HTR6 (0.46) KMT2AHTR6MAPTTSHRGAA
SCHEMBL6929151 0.83 GAA (0.40) KMT2ASMN1; SMN2HTTGAALMNA
SCHEMBL5850131 0.83 HTR6 (0.41) KMT2AHTR6GAALMNAALDH1A1
SCHEMBL3127290 0.82 CA12 (0.40) KMT2ASMN1; SMN2HTTGAALMNA
SCHEMBL3132636 0.82 GAA (0.40) KMT2ASMN1; SMN2HTTMAPTTSHR
Trifluoromethanesulfonic Acid SCHEMBL1809323 0.81 ACHE (0.39) KMT2AHTR6HTTTSHRLMNA
SCHEMBL7133269 0.81 CA12 (0.47) KMT2ASMN1; SMN2HTTGAALMNA
SCHEMBL64189 0.81 CA12 (0.47) KMT2ASMN1; SMN2HTTGAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6984473-B2 Light blocking; amplified photoresist; acid generators; high density semiconductors MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 2006-01-10 US disclosed
US-20030152845-A1 Mask blank, protective film therefor and method of patterning mask blank MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 2003-08-14 US disclosed