SCHEMBL7784949

SCHEMBL7784949

O=S(=O)(O)c1cccc(S(=O)(=O)O)c1O.[NaH].[NaH]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.48
CYP1A2 P05177 2/20 0.44
PGAM1 P18669 1/20 0.41
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
MYC P01106 1/20 0.41
CDK2 P24941 2/20 0.40
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ATIC P31939 1/20 0.39
FABP4 P15090 1/20 0.39
CCNA2 P20248 1/20 0.39
MAPK14 Q16539 1/20 0.39
LMNA P02545 1/20 0.39
NR4A1 P22736 1/20 0.38
COMT P21964 1/20 0.37
MPL P40238 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TDP1 Q9NUW8 2/20 0.37

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
SCHEMBL9446869 0.97 TTR (0.50) TTRCYP1A2PGAM1AURKAAURKB
SCHEMBL2466366 0.88 CDK2 (0.48) TTRCYP1A2PGAM1AURKAAURKB
SCHEMBL7737810 0.88 CDK2 (0.48) TTRCYP1A2PGAM1AURKAAURKB
SCHEMBL11199056 0.88 CDK2 (0.48) TTRCYP1A2PGAM1AURKAAURKB
SCHEMBL29470806 0.85 CDK2 (0.50) TTRCYP1A2PGAM1AURKAAURKB
SCHEMBL8517108 0.85 PGAM1 (0.47) TTRCYP1A2PGAM1AURKAAURKB
SCHEMBL114040 0.85 CDK2 (0.50) TTRCYP1A2PGAM1AURKAAURKB
SCHEMBL28396990 0.84 ALDH1A1 (0.52) TTRCYP1A2PGAM1MYCATIC
SCHEMBL7737818 0.83 LMNA (0.48) TTRCYP1A2PGAM1AURKAAURKB
Potassium SCHEMBL8940728 0.83 CDK2 (0.48) TTRCYP1A2PGAM1AURKAAURKB

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-1140731-A2 POROUS CERAMIC MATRICES SUITABLE AS CATALYSTS SUPPORT DYTECH CORPORATION LIMITED (GB) 2001-10-10 EP disclosed
WO-2000029353-A2 POROUS CERAMIC MATRICES SUITABLE AS CATALYSTS SUPPORT DYTECH CORPORATION LIMITED (GB) 2000-05-25 WO disclosed