SCHEMBL8517162

SCHEMBL8517162

O=S(=O)(O)c1cccc(-c2ccc(O)cc2)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.44
LMNA P02545 1/20 0.42
BACE1 P56817 3/20 0.41
ABL1 P00519 1/20 0.41
ABCB1 P08183 1/20 0.41
BCR P11274 1/20 0.41
FABP1 P07148 1/20 0.40
PTPN1 P18031 1/20 0.39
STAT3 P40763 1/20 0.39
ESR2 Q92731 2/20 0.38
TTR P02766 1/20 0.38
HNF4A P41235 1/20 0.38
ESR1 P03372 4/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
CYP1A2 P05177 1/20 0.36

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
SCHEMBL8368643 0.87 HDAC4 (0.52) PGAM1BACE1STAT3TTRHNF4A
SCHEMBL6678668 0.87 ALPL (0.43) BACE1ABL1ABCB1BCRFABP1
SCHEMBL890902 0.85 ABL1 (0.48) PGAM1LMNABACE1ABL1ABCB1
SCHEMBL8517108 0.84 PGAM1 (0.47) PGAM1LMNASTAT3TTRCYP1A2
SCHEMBL17888508 0.82 NPC1 (0.44) PGAM1STAT3TTRHNF4AHDAC4
SCHEMBL8517059 0.81 PGAM1 (0.44) PGAM1LMNASTAT3TTRMEN1
SCHEMBL10956301 0.80 CD40 (0.45) LMNAMEN1KMT2AMMP2
SCHEMBL23433029 0.79 LMNA (0.46) LMNABACE1ABL1ABCB1BCR
SCHEMBL9446869 0.77 TTR (0.50) PGAM1LMNATTRCYP1A2
SCHEMBL9464038 0.77 ABL1 (0.56) LMNABACE1ABL1ABCB1BCR

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