SCHEMBL8768792

SCHEMBL8768792

CC(C)(C)c1cc(S(N)(=O)=O)cc(C(C)(C)C)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.52
CA1 P00915 5/20 0.52
ALDH1A1 P00352 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
POLB P06746 1/20 0.50
TYR P14679 1/20 0.50
GABBR2 O75899 2/20 0.47
GABBR1 Q9UBS5 2/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GALR3 O60755 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 3/20 0.45
ALOX15 P16050 2/20 0.45
HPN P05981 1/20 0.45
SIRT5 Q9NXA8 1/20 0.45
CA12 O43570 3/20 0.44
CA9 Q16790 3/20 0.44
CYP1A2 P05177 3/20 0.44

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
SCHEMBL18646038 0.89 CYP1A2 (0.53) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL13522250 0.83 CA2 (0.56) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL6858911 0.81 CA2 (0.54) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL1962153 0.81 CA2 (0.54) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL4710701 0.81 CA2 (0.54) CA2CA1ALDH1A1SMN1; SMN2POLB
Ammonia Solution, Strong SCHEMBL25385967 0.79 CA2 (0.52) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL4894218 0.79 CA2 (0.52) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL1960304 0.79 CA2 (0.52) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL11529072 0.79 CA2 (0.47) CA2CA1ALDH1A1SMN1; SMN2POLB
Potassium Ion SCHEMBL1960305 0.78 CA2 (0.50) CA2CA1ALDH1A1SMN1; SMN2POLB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0659738-B1 N-(Carbonyl, carbonimidoyl, carbonothioyl) sulfonamide charge control agents and toners and developers EASTMAN KODAK CO (US) 1997-09-10 EP disclosed
US-5616797-A USED IN ELECTROPHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1997-04-01 US disclosed
US-5523484-A DI- OR TRI-CARBONYL SULFONAMIDO-PHENYL COMPOUNDS AS CHARGE CONTROL AGENTS EASTMAN KODAK COMPANY (US) 1996-06-04 US disclosed
EP-0659738-A1 N-(Carbonyl, carbonimidoyl, carbonothioyl) sulfonamide charge control agents and toners and developers EASTMAN KODAK COMPANY (US) 1995-06-28 EP disclosed
US-5405727-A Electrophotography EASTMAN KODAK COMPANY (US) 1995-04-11 US disclosed
US-5385800-A A metal-free, colorless, heat resistant controllers EASTMAN KODAK COMPANY (US) 1995-01-31 US disclosed