SCHEMBL8367649

SCHEMBL8367649

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
BRD4 O60885 1/20 0.37
RECQL P46063 3/20 0.36
POLB P06746 2/20 0.36
ESR2 Q92731 1/20 0.36
MYC P01106 1/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
HSD17B10 Q99714 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
TP53 P04637 2/20 0.35
CYP3A4 P08684 2/20 0.35
GAA P10253 2/20 0.35
GLA P06280 1/20 0.35
NT5E P21589 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP2D6 P10635 2/20 0.34

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
SCHEMBL11764661 0.85 BRD4 (0.41) MEN1KMT2ABRD4RECQLPOLB
SCHEMBL1808650 0.85 ALDH1A1 (0.40) BRD4RECQLPOLBESR2ALDH1A1
SCHEMBL7536401 0.84 CYP2D6 (0.39) MYCALDH1A1HPGDHSD17B10TDP1
SCHEMBL11811420 0.83 BRD4 (0.42) MEN1KMT2ABRD4RECQLPOLB
SCHEMBL31261055 0.81 MEN1 (0.45) MEN1KMT2ABRD4RECQLPOLB
SCHEMBL5202112 0.81 TRPA1 (0.38) MEN1KMT2ARECQLPOLBALDH1A1
SCHEMBL1017902 0.81 MEN1 (0.45) MEN1KMT2ABRD4RECQLPOLB
SCHEMBL8517009 0.81 NQO1 (0.41) MEN1KMT2ABRD4RECQLPOLB
SCHEMBL2227316 0.81 MEN1 (0.41) MEN1KMT2ABRD4RECQLPOLB
SCHEMBL16343725 0.79 ALDH1A1 (0.41) MEN1KMT2ARECQLPOLBESR2

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