SCHEMBL1768495

SCHEMBL1768495

O=S(=O)(c1ccccc1)N(O)C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 1/20 0.54
NR1H3 Q13133 6/20 0.49
NR1H2 P55055 5/20 0.49
NR1I2 O75469 5/20 0.44
RORA P35398 2/20 0.43
RORC P51449 2/20 0.43
RORB Q92753 2/20 0.43
NR1H4 Q96RI1 2/20 0.43
HSD11B1 P28845 2/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
RXRA P19793 1/20 0.42
SREBF1 P36956 1/20 0.42
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
NR1I3 Q14994 1/20 0.42
APH1B Q8WW43 1/20 0.42

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
SCHEMBL3279350 0.79 APOBEC3G (0.48) APOBEC3GNR1H3NR1H2NR1I2HSD11B1
SCHEMBL2512045 0.78 APOBEC3G (0.58) APOBEC3GNR1H3NR1H2NR1I2RORA
SCHEMBL7783984 0.76 APOBEC3G (0.67) APOBEC3GNR1H3HSD11B1KMT2ATSHR
SCHEMBL27794695 0.75 APOBEC3G (0.54) APOBEC3GNR1H3NR1H2NR1I2RORA
SCHEMBL1868116 0.75 APOBEC3G (0.54) APOBEC3GNR1H3NR1H2NR1I2RORA
SCHEMBL4243059 0.75 APOBEC3G (0.58) APOBEC3GHSD11B1KMT2ATSHRSMN1; SMN2
SCHEMBL29202770 0.75 APOBEC3G (0.58) APOBEC3GHSD11B1KMT2ATSHRSMN1; SMN2
SCHEMBL6917666 0.73 NR1H3 (0.69) APOBEC3GNR1H3NR1H2NR1I2RORA
SCHEMBL11220474 0.73 APOBEC3G (0.52) APOBEC3GNR1H3NR1H2NR1I2RORA
SCHEMBL3283058 0.72 APOBEC3G (0.50) APOBEC3GNR1I2HSD11B1KMT2ATSHR

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
WO-2011063339-A1 NITROXYL DONORS FOR THE TREATMENT OF PULMONARY HYPERTENSION CARDIOXYL PHARMACEUTICALS, INC. (US) 2011-05-26 WO claimed
JP-58198456-A None JP disclosed
JP-58201704-A None JP disclosed
US-20250155405-A1 METHOD FOR IDENTIFYING UNSATURATED ORGANIC COMPOUND, AND MASS SPECTROMETRY SYSTEM SHIMADZU CORPORATION (JP) 2025-05-15 US disclosed
JP-S58201704-A HERBICIDE CONTAINING N-PERFLUOROALKYL-N- HYDROXYARYLSULFONAMIDE DERIVATIVE NISSAN CHEM IND LTD 1983-11-24 JP disclosed
JP-S58198456-A N-PERFLUOROALKYL-N-HYDROXYARYLSULFONAMIDE SAGAMI CHEM RES CENTER 1983-11-18 JP disclosed