SCHEMBL8501628

SCHEMBL8501628

Cc1ccc(S(=O)(=O)Oc2c(F)cccc2C2c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VDR P11473 1/20 0.42
HTR6 P50406 1/20 0.41
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
DHODH Q02127 1/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
ESR1 P03372 1/20 0.39
GAA P10253 1/20 0.39
ESR2 Q92731 1/20 0.39
ALDH1A1 P00352 4/20 0.37
LMNA P02545 2/20 0.37
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
PPIA P62937 1/20 0.37
MAPT P10636 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
POLB P06746 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
SCHEMBL8500025 0.85 LMNA (0.43) VDRHTR6KEAP1NFE2L2DHODH
SCHEMBL8498899 0.81 LMNA (0.42) VDRHTR6KEAP1NFE2L2DHODH
SCHEMBL8501386 0.80 HTR6 (0.51) VDRHTR6KEAP1NFE2L2DHODH
SCHEMBL3839070 0.77 VDR (0.42) VDRKEAP1NFE2L2DHODHKMT2A
SCHEMBL30620509 0.75 KMT2A (0.40) VDRKEAP1NFE2L2DHODHKMT2A
SCHEMBL8501624 0.74 ALDH1A1 (0.40) VDRHTR6KEAP1NFE2L2DHODH
SCHEMBL3845351 0.72 KEAP1 (0.39) VDRKEAP1NFE2L2KMT2AMEN1
SCHEMBL8498762 0.72 MEN1 (0.39) VDRKEAP1NFE2L2DHODHKMT2A
SCHEMBL4120837 0.71 LMNA (0.56) VDRHTR6KEAP1NFE2L2KMT2A
SCHEMBL30620518 0.71 ALDH1A1 (0.42) VDRKMT2AMEN1ESR1GAA

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
EP-0956312-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR Corporation (JP) 1999-11-17 EP disclosed
WO-1998033836-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR CORPORATION (JP) 1998-08-06 WO disclosed