SCHEMBL8495335

SCHEMBL8495335

COc1c(C)cc(S(=O)(=O)c2cc(C)c(O)c(C)c2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX2 P34913 3/20 0.41
ALOX5 P09917 2/20 0.40
PTGS1 P23219 2/20 0.40
PTGS2 P35354 2/20 0.40
PKM P14618 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
BRD4 O60885 1/20 0.38
CYTH2 Q99418 1/20 0.38
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL8400899 0.90 POLB (0.43) NAMPTPTGS1PTGS2PKMGAA
SCHEMBL359985 0.85 CA1 (0.50) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL142565 0.85 CA1 (0.50) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL8400894 0.84 NAMPT (0.41) NAMPTPKMALDH1A1POLBTSHR
SCHEMBL8496818 0.80 CYTH2 (0.35) NAMPTMEN1KMT2APTGS1PTGS2
SCHEMBL14700563 0.80 MAPT (0.44) NAMPTKMT2APKMGAAALDH1A1
SCHEMBL16308957 0.78 ALDH1A1 (0.42) NAMPTGAAALDH1A1CYTH2TSHR
SCHEMBL19596581 0.77 CA1 (0.67) EPHX2ALOX5PTGS1PTGS2ALDH1A1
SCHEMBL15894599 0.74 CYTH2 (0.59) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL10711786 0.74 ALDH1A1 (0.42) MEN1KMT2APKMGAAALDH1A1

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-0697291-B1 4-HYDROXY-4'-ISOPROPOXYDIPHENYL SULFONE DEVELOPER COMPOSITION, WET PULVERIZING METHOD, AND DISPERSION NIPPON SODA CO (JP) 1999-06-16 EP disclosed
US-5609672-A Composition for color development comprising 4-hydroxy-4'-isopropoxydiphenylsulfone, and a wet method for grinding and a dispersible solution for applying the same NIPPON SODA CO., LTD. (JP) 1997-03-11 US disclosed
EP-0697291-A1 4-HYDROXY-4'-ISOPROPOXYDIPHENYL SULFONE DEVELOPER COMPOSITION, WET PULVERIZING METHOD, AND DISPERSION NIPPON SODA CO., LTD. (JP) 1996-02-21 EP disclosed