SCHEMBL8370568

SCHEMBL8370568

CCc1cc(S(=O)(=O)O)cc(C(C)c2ccc(C(C)c3ccccc3)cc2)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.39
TSHR P16473 2/20 0.37
HTT P42858 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
GAA P10253 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
BRD4 O60885 1/20 0.34
GRM2 Q14416 2/20 0.33
HKDC1 Q2TB90 1/20 0.33
CYP2D6 P10635 2/20 0.33
POLB P06746 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
PMP22 Q01453 1/20 0.33

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
SCHEMBL8367572 0.97 TYR (0.41) TYRTSHRHTTNPSR1GAA
SCHEMBL8370519 0.86 TYR (0.47) TYRTSHRHTTNPSR1GAA
SCHEMBL8370432 0.85 TYR (0.45) TYRTSHRHTTNPSR1GAA
SCHEMBL8368715 0.82 TRPA1 (0.38) TSHRHTTNPSR1SMN1; SMN2HKDC1
SCHEMBL8516553 0.82 TYR (0.40) TYRTSHRHTTNPSR1GAA
SCHEMBL8365895 0.82 TYR (0.47) TYRTSHRHTTNPSR1GAA
SCHEMBL8370496 0.82 TYR (0.39) TYRTSHRHTTNPSR1GAA
SCHEMBL8370448 0.81 TYR (0.43) TYRTSHRHTTNPSR1GAA
SCHEMBL8367589 0.78 TYR (0.41) TYRTSHRHTTNPSR1GAA
SCHEMBL8368679 0.78 PGAM1 (0.41) TYRTSHRNPSR1BRD4GRM2

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