SCHEMBL8055324

SCHEMBL8055324

O=Cc1ccc(S(=O)(=O)O)c(C=O)c1S(=O)(=O)O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAD1 O60671 1/20 0.34
P2RY6 Q15077 1/20 0.34
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ENPP2 Q13822 1/20 0.32
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
ALOX15 P16050 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ERN1 O75460 2/20 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
SCHEMBL7189933 0.89 TTR (0.32) RAD1P2RY6MEN1LMNAKMT2A
SCHEMBL224921 0.77 TDP1 (0.44) MEN1LMNATHRBBLMKMT2A
SCHEMBL3199219 0.76 TDP1 (0.38) RAD1P2RY6TDP1ENPP2
SCHEMBL28565466 0.75 TDP1 (0.42) MEN1LMNATHRBBLMKMT2A
SCHEMBL21291579 0.74 RAD1 (0.43) RAD1P2RY6LMNATDP1ENPP2
SCHEMBL10921837 0.74 TSHR (0.41) LMNATDP1ALDH1A1CYP1A2ALOX15
SCHEMBL3294201 0.73 TTR (0.47) MEN1LMNAKMT2ATDP1ALDH1A1
SCHEMBL7184712 0.72 TTR (0.47) MEN1LMNATHRBBLMKMT2A
SCHEMBL17982110 0.71 TTR (0.45) MEN1LMNAKMT2ATDP1ALDH1A1
SCHEMBL28375176 0.71 TTR (0.45) MEN1LMNAKMT2ATDP1ALDH1A1

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-6140003-A POLYESTERS AND PIGMENTS XEROX CORPORATION (US) 2000-10-31 US disclosed