SCHEMBL8370537

SCHEMBL8370537

CC(c1ccccc1)c1ccccc1C(C)(C)c1ccc(O)c(S(=O)(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.40
RORC P51449 1/20 0.36
LMNA P02545 5/20 0.35
HPGD P15428 4/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 4/20 0.33
ESR1 P03372 3/20 0.33
CHRM2 P08172 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
HRH1 P35367 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
CHRM4 P08173 1/20 0.33
KCNE1 P15382 1/20 0.33
PTGS1 P23219 1/20 0.33
HRH2 P25021 1/20 0.33
HTR2A P28223 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
SCHEMBL8365853 0.98 TYR (0.38) TYRRORCLMNAHPGDHIF1A
SCHEMBL8367490 0.85 RORC (0.38) RORCLMNAHPGDHIF1AHSD17B10
SCHEMBL8369683 0.82 ESR1 (0.43) LMNAHPGDHIF1AHSD17B10ESR1
SCHEMBL8370535 0.79 TYR (0.36) TYRLMNAHPGDHIF1AMAPT
SCHEMBL2339675 0.77 ESR1 (0.52) RORCLMNAHPGDHIF1AHSD17B10
SCHEMBL8370557 0.76 LMNA (0.43) TYRLMNAHPGDHIF1AHSD17B10
SCHEMBL8368874 0.76 LMNA (0.43) TYRLMNAHPGDHIF1AHSD17B10
SCHEMBL8516554 0.76 TYR (0.44) TYRLMNAHPGDHIF1AHSD17B10
SCHEMBL10599648 0.75 CRHBP (0.40) TYRLMNAMAPTESR1CHRM2
SCHEMBL11054731 0.75 ESR1 (0.55) RORCLMNAHPGDHIF1AHSD17B10

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