SCHEMBL8516707

SCHEMBL8516707

Cc1ccc(C(C)c2ccccc2)c(O)c1-c1c(O)ccc(S(=O)(=O)O)c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.39
GAA P10253 3/20 0.33
TSHR P16473 2/20 0.33
HTT P42858 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HPGD P15428 2/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
ALDH1A1 P00352 4/20 0.32
HSD17B10 Q99714 1/20 0.32
NQO1 P15559 1/20 0.32
PGAM1 P18669 1/20 0.32
TNNI3 P19429 1/20 0.31
TNNT2 P45379 1/20 0.31
TNNC1 P63316 1/20 0.31
HKDC1 Q2TB90 1/20 0.31
ELANE P08246 1/20 0.31
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL8516824 0.90 TYR (0.44) TYRGAATSHRHTTNPSR1
SCHEMBL8516648 0.89 TYR (0.38) TYRGAATSHRHTTNPSR1
SCHEMBL8516638 0.88 TYR (0.42) TYRGAATSHRHTTNPSR1
SCHEMBL8517032 0.86 GAA (0.35) GAATSHRHTTHPGDALDH1A1
SCHEMBL8516881 0.81 TYR (0.37) TYRGAATSHRHTTNPSR1
SCHEMBL8516633 0.79 NQO1 (0.44) GAANPSR1HPGDALDH1A1HSD17B10
SCHEMBL8516616 0.78 TYR (0.36) TYRGAATSHRHTTNPSR1
SCHEMBL8517744 0.76 TRPA1 (0.37) TYRGAATSHRHTTHPGD
SCHEMBL8516690 0.75 TYR (0.38) TYRGAATSHRHTTNPSR1
SCHEMBL8367574 0.75 VKORC1 (0.38) TYRGAAHTTNPSR1HPGD

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 2 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
EP-0714785-A1 Sulfonated phenol (salt) containing color-developing agents and color-developing sheets MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-06-05 EP disclosed