SCHEMBL27733587

SCHEMBL27733587

O=[SH](=O)c1ccccc1N(C(F)(F)F)S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 5/20 0.47
NR1H2 P55055 4/20 0.47
APOBEC3G Q9HC16 1/20 0.42
HTR6 P50406 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
RORC P51449 4/20 0.35
NR1I2 O75469 4/20 0.34
ESR1 P03372 1/20 0.34
RORA P35398 1/20 0.33
RORB Q92753 1/20 0.33
NR1H4 Q96RI1 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
SCHEMBL6917666 0.74 NR1H3 (0.69) NR1H3NR1H2APOBEC3GRORCNR1I2
SCHEMBL2512045 0.68 APOBEC3G (0.58) NR1H3NR1H2APOBEC3GHTR6TDP1
SCHEMBL10873132 0.68 NR1H3 (0.55) NR1H3NR1H2
SCHEMBL3398530 0.67 NR1H2 (0.55) NR1H3NR1H2APOBEC3GRORCNR1I2
SCHEMBL8740801 0.66 NR1H2 (0.41) NR1H3NR1H2
SCHEMBL7211483 0.66 PKM (0.58) NR1H3NR1H2APOBEC3GRORCNR1I2
SCHEMBL28793753 0.66 NR1H3 (0.54) NR1H3NR1H2APOBEC3GRORCNR1I2
SCHEMBL1868116 0.65 APOBEC3G (0.54) NR1H3NR1H2APOBEC3GHTR6TDP1
SCHEMBL1768495 0.65 APOBEC3G (0.54) NR1H3NR1H2APOBEC3GRORCNR1I2
SCHEMBL11406942 0.65 NR1H3 (0.56) NR1H3NR1H2APOBEC3GRORCNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101208299-A Diarylsulfone sulfonamides and use therof WYETH CORP (US) 2008-06-25 CN disclosed