SCHEMBL10695718

SCHEMBL10695718

Nc1ccccc1NS(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 9/20 0.46
HDAC1 Q13547 9/20 0.46
HDAC2 Q92769 8/20 0.46
MAPK1 P28482 1/20 0.46
GAA P10253 3/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
CYP2C9 P11712 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
NCOR2 Q9Y618 4/20 0.43
HDAC10 Q969S8 4/20 0.43
HDAC6 Q9UBN7 4/20 0.43
HDAC4 P56524 3/20 0.43
HDAC7 Q8WUI4 3/20 0.43

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
SCHEMBL6684548 0.84 TSHR (0.42) MAPK1GAAMAPTMEN1LMNA
SCHEMBL19439099 0.80 CA2 (0.52) HDAC3HDAC1HDAC2MAPK1GAA
SCHEMBL27439209 0.79 HDAC3 (0.43) HDAC3HDAC1HDAC2MAPK1GAA
SCHEMBL15938352 0.79 HDAC1 (0.40) HDAC3HDAC1HDAC2MAPK1GAA
SCHEMBL29396266 0.78 KEAP1 (0.55) GAAMAPTKDM4ECYP2C9MEN1
SCHEMBL449212 0.78 KEAP1 (0.55) GAAMAPTKDM4ECYP2C9MEN1
SCHEMBL18669987 0.77 HDAC3 (0.46) HDAC3HDAC1HDAC2MAPK1GAA
SCHEMBL30442098 0.77 HDAC3 (0.46) HDAC3HDAC1HDAC2MAPK1GAA
Sulfuric Acid SCHEMBL5843676 0.77 HDAC3 (0.44) HDAC3HDAC1HDAC2MAPK1GAA
Hydrochloric Acid SCHEMBL8118011 0.77 KEAP1 (0.53) GAAMAPTKDM4ECYP2C9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0279016-A2 Powdered hair dye HOYU CO., LTD. (JP) 1988-08-24 EP claimed
EP-0279016-A2 Powdered hair dye HOYU CO., LTD. (JP) 1988-08-24 EP disclosed
EP-0059354-B1 COLOUR PHOTOGRAPHIC RECORDING MATERIAL Agfa-Gevaert AG (DE) 1984-06-20 EP disclosed
US-4418143-A Color photographic recording material AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1983-11-29 US disclosed
EP-0059354-A1 Colour photographic recording material Agfa-Gevaert AG (DE) 1982-09-08 EP disclosed