SCHEMBL8370432

SCHEMBL8370432

CC(c1ccccc1)c1ccc(C(C)c2cc(S(=O)(=O)O)cc(O)c2O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.45
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NSD2 O96028 2/20 0.37
DUSP3 P51452 1/20 0.37
PTPN5 P54829 1/20 0.37
CASP7 P55210 1/20 0.37
CASP6 P55212 1/20 0.37
PTPN11 Q06124 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
GAA P10253 2/20 0.37
HTT P42858 2/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
APEX1 P27695 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
HKDC1 Q2TB90 1/20 0.36
POLB P06746 2/20 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
SCHEMBL8365895 0.97 TYR (0.47) TYRTSHRSMN1; SMN2NSD2DUSP3
SCHEMBL8370519 0.90 TYR (0.47) TYRTSHRSMN1; SMN2NSD2DUSP3
SCHEMBL8516553 0.85 TYR (0.40) TYRTSHRSMN1; SMN2NSD2DUSP3
SCHEMBL8370568 0.85 TYR (0.39) TYRTSHRSMN1; SMN2PTPN11NPSR1
SCHEMBL8370496 0.85 TYR (0.39) TYRTSHRSMN1; SMN2NPSR1GAA
SCHEMBL8370448 0.84 TYR (0.43) TYRTSHRSMN1; SMN2NSD2DUSP3
SCHEMBL8365957 0.84 TYR (0.49) TYRTSHRSMN1; SMN2NSD2DUSP3
SCHEMBL8367572 0.82 TYR (0.41) TYRTSHRSMN1; SMN2PTPN11NPSR1
SCHEMBL8367589 0.82 TYR (0.41) TYRTSHRSMN1; SMN2NPSR1GAA
SCHEMBL8365926 0.81 TYR (0.45) TYRTSHRSMN1; SMN2PTPN11NPSR1

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