SCHEMBL8281163

SCHEMBL8281163

Cc1cc(S(=O)(=O)Nc2ccc(N(C)C)cc2)c(O)cc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 5/20 0.57
ALDH1A1 P00352 9/20 0.53
MAPT P10636 3/20 0.53
HTT P42858 2/20 0.53
GAA P10253 4/20 0.52
TDP1 Q9NUW8 3/20 0.52
LMNA P02545 3/20 0.52
MAPK1 P28482 2/20 0.52
MCL1 Q07820 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
TSHR P16473 2/20 0.47
HSD17B10 Q99714 1/20 0.45
ACLY P53396 1/20 0.43
HSD17B2 P37059 1/20 0.43
POLB P06746 1/20 0.42
ACHE P22303 1/20 0.41
PPARG P37231 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL8281149 0.79 ALDH1A1 (0.52) GFERALDH1A1MAPTHTTGAA
SCHEMBL14018752 0.77 ALDH1A1 (0.68) GFERALDH1A1MAPTHTTGAA
SCHEMBL8279547 0.76 P2RX1 (0.53) GFERALDH1A1MAPTHTTTDP1
SCHEMBL20202313 0.75 ALDH1A1 (0.66) GFERALDH1A1MAPTHTTGAA
SCHEMBL24876579 0.71 LMNA (0.73) GFERALDH1A1MAPTHTTGAA
SCHEMBL6676320 0.70 ALDH1A1 (0.55) GFERALDH1A1MAPTHTTGAA
SCHEMBL14018748 0.70 ALDH1A1 (1.00) GFERALDH1A1MAPTHTTTDP1
SCHEMBL4880800 0.70 MAPT (0.79) GFERALDH1A1MAPTHTTTDP1
SCHEMBL11571406 0.69 CA1 (0.66) GFERALDH1A1MAPTHTTGAA
SCHEMBL1646021 0.69 CA1 (1.00) GFERALDH1A1MAPTHTTTDP1

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