SCHEMBL8516683

SCHEMBL8516683

O=S(=O)(O)c1cc(-c2ccc(O)cc2)c(O)c(S(=O)(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
ING2 Q9H160 1/20 0.39
PGAM1 P18669 1/20 0.38
HSD17B10 Q99714 3/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NSD2 O96028 1/20 0.36
MMP14 P50281 1/20 0.36
CASP6 P55212 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
PTGS2 P35354 1/20 0.36
FYN P06241 1/20 0.35
MAP4K4 O95819 1/20 0.35
MINK1 Q8N4C8 1/20 0.35
TNIK Q9UKE5 1/20 0.35
ABL1 P00519 1/20 0.35
ABCB1 P08183 1/20 0.35

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
SCHEMBL8367637 0.86 TSHR (0.45) ING2PGAM1HSD17B10NSD2CASP6
SCHEMBL8517095 0.84 ING2 (0.42) LMNAING2PGAM1HSD17B10CYP2C9
SCHEMBL8517286 0.83 HSD17B10 (0.40) LMNAING2PGAM1HSD17B10CYP2C9
SCHEMBL8516658 0.83 ING2 (0.48) LMNAING2PGAM1HSD17B10CYP2C9
SCHEMBL3495112 0.77 ING2 (0.54) LMNAING2PGAM1HSD17B10CYP2C9
SCHEMBL8517631 0.76 ALDH1A1 (0.49) LMNAING2PGAM1HSD17B10CYP2C9
SCHEMBL8516622 0.76 ESR1 (0.52) LMNAPGAM1HSD17B10CYP2C9CYP2C19
SCHEMBL7590808 0.75 ING2 (0.48) LMNAING2PGAM1HSD17B10CYP2C9
SCHEMBL8517162 0.75 PGAM1 (0.44) LMNAPGAM1ABL1ABCB1BCR
SCHEMBL8516470 0.75 LMNA (0.57) LMNAHSD17B10CYP2C9CYP2C19PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714785-B1 Sulfonated phenol (salt) containing color-developing agents and color-developing sheets MITSUI CHEMICALS INC (JP) 1999-01-07 EP disclosed
US-5647896-A MULTIVALENT SALT OF A SALICYLIC ACID DERIVATIVE, SULFONATED PHENOL MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-15 US disclosed
EP-0714785-A1 Sulfonated phenol (salt) containing color-developing agents and color-developing sheets MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-06-05 EP disclosed