SCHEMBL8280452

SCHEMBL8280452

CN(C)c1ccc(NS(=O)(=O)c2ccc(-c3ccc(O)cc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.68
MAPT P10636 4/20 0.68
ALDH1A1 P00352 3/20 0.68
TDP1 Q9NUW8 3/20 0.68
UQCRB P14927 3/20 0.68
GFER P55789 2/20 0.68
MAPK1 P28482 1/20 0.68
MCL1 Q07820 1/20 0.68
POLB P06746 1/20 0.55
GAA P10253 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HTT P42858 1/20 0.54
UCHL1 P09936 1/20 0.53
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
NPY5R Q15761 2/20 0.49
HSPD1 P10809 2/20 0.48
PTPN1 P18031 2/20 0.48

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
SCHEMBL30828575 0.92 ALDH1A1 (0.78) LMNAMAPTALDH1A1TDP1UQCRB
SCHEMBL21086838 0.87 UQCRB (0.86) LMNAMAPTALDH1A1UQCRBGFER
SCHEMBL14018736 0.85 ALDH1A1 (0.91) LMNAMAPTALDH1A1TDP1GFER
SCHEMBL1592323 0.82 UQCRB (0.76) LMNAMAPTALDH1A1UQCRBGFER
SCHEMBL8279538 0.81 ALDH1A1 (0.62) LMNAMAPTALDH1A1TDP1GFER
SCHEMBL6296969 0.81 UQCRB (1.00) LMNAMAPTALDH1A1UQCRBGFER
SCHEMBL2832955 0.80 MAPT (0.73) LMNAMAPTALDH1A1TDP1GFER
SCHEMBL5718766 0.79 ALDH1A1 (0.73) LMNAMAPTALDH1A1TDP1GFER
SCHEMBL28032113 0.79 ALDH1A1 (0.73) LMNAMAPTALDH1A1TDP1GFER
SCHEMBL930602 0.77 MAPT (0.82) LMNAMAPTALDH1A1TDP1UQCRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005090298-A1 SULPHONAMIDE DERIVATIVES BIOTIE THERAPIES CORPORATION (FI) 2005-09-29 WO disclosed