SCHEMBL6771382

SCHEMBL6771382

O=S(=O)(O)c1ccc(Br)c(S(=O)(=O)O)c1S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.33
CA1 P00915 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
TTR P02766 1/20 0.32
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
COMT P21964 1/20 0.32
AURKA O14965 1/20 0.32
AURKB Q96GD4 1/20 0.32
PLCG1 P19174 1/20 0.31
FABP4 P15090 1/20 0.31
LMNA P02545 1/20 0.31
MYC P01106 1/20 0.31
ALDH1A1 P00352 2/20 0.30
CYP2D6 P10635 1/20 0.30
CYP1A2 P05177 1/20 0.30
ALOX15 P16050 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL10921837 0.84 TSHR (0.41) TTRTSHRSMN1; SMN2COMTAURKA
SCHEMBL28244623 0.79 CA1 (0.46) CA2CA1CA4CA6TTR
SCHEMBL31357035 0.78 TSHR (0.33) CA2CA1CA4CA6TSHR
SCHEMBL31357038 0.76 CA2 (0.33) CA2CA1CA4CA6TTR
SCHEMBL9615691 0.76 CA2 (0.33) CA2CA1CA4CA6TTR
SCHEMBL6267483 0.76 TTR (0.32) TTRTSHRSMN1; SMN2COMTAURKA
SCHEMBL3135187 0.75 CA2 (0.41) CA2CA1CA4CA6TTR
SCHEMBL8740780 0.73 COMT (0.44) TTRTSHRSMN1; SMN2COMTAURKA
Hydrochloric Acid SCHEMBL27308694 0.73 CA2 (0.39) CA2CA1CA4CA6TTR
SCHEMBL1301837 0.73 CA1 (0.34) CA2CA1CA4CA6TTR

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
US-20040258940-A1 Recording sheet and method for recording image using the same FUJI XEROX CO., LTD. (JP) 2004-12-23 US disclosed