SCHEMBL9367198

SCHEMBL9367198

CC(NC(=O)c1ccccc1S(=O)(=O)Nc1ccc(F)c(C(F)(F)F)c1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 5/20 0.60
FABP5 Q01469 4/20 0.43
FABP4 P15090 4/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
AR P10275 1/20 0.42
KAT6A Q92794 1/20 0.41
MMP2 P08253 1/20 0.41
MMP13 P45452 1/20 0.41
GRM4 Q14833 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
S1PR1 P21453 1/20 0.40
MCL1 Q07820 1/20 0.40
HSPD1 P10809 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN5 P54829 1/20 0.39
HSPE1 P61604 1/20 0.39

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
SCHEMBL9499726 0.89 SLC22A12 (0.56) SLC22A12FABP5FABP4MEN1KMT2A
SCHEMBL9363833 0.89 SLC22A12 (0.56) SLC22A12FABP5FABP4MEN1ALDH1A1
SCHEMBL9364384 0.87 SLC22A12 (0.58) SLC22A12FABP5FABP4MEN1ALDH1A1
SCHEMBL9363377 0.85 SLC22A12 (0.56) SLC22A12FABP5FABP4MEN1ALDH1A1
SCHEMBL9368795 0.84 SLC22A12 (0.72) SLC22A12FABP5FABP4MEN1ALDH1A1
SCHEMBL9499366 0.82 SLC22A12 (0.53) SLC22A12FABP5FABP4MEN1KMT2A
SCHEMBL9501130 0.82 SLC22A12 (0.57) SLC22A12FABP5FABP4MEN1ALDH1A1
SCHEMBL9364368 0.82 MEN1 (0.47) SLC22A12MEN1ALDH1A1KMT2AKAT6A
SCHEMBL9364058 0.81 SLC22A12 (0.62) SLC22A12FABP5FABP4MEN1ALDH1A1
SCHEMBL9364311 0.81 CA2 (0.50) SLC22A12FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0447013-B1 Fluorobenzene sulphonamides SCHERING AG (DE) 1994-08-03 EP disclosed
US-5210290-A NMR diagnostic aid SCHERING AKTIENGESELLSCHAFT (DE) 1993-05-11 US disclosed
EP-0447013-A1 Fluorobenzene sulphonamides SCHERING AKTIENGESELLSCHAFT (DE) 1991-09-18 EP disclosed