SCHEMBL11407296

SCHEMBL11407296

Nc1ccccc1S(=O)(=O)CCl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.58
CA9 Q16790 3/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA4 P22748 3/20 0.56
CA12 O43570 2/20 0.56
CA6 P23280 2/20 0.56
CYP2C9 P11712 1/20 0.56
CA5A P35218 1/20 0.56
CA7 P43166 1/20 0.56
CA14 Q9ULX7 1/20 0.56
CA5B Q9Y2D0 1/20 0.56
KYNU Q16719 2/20 0.51
HTR6 P50406 1/20 0.50
TTR P02766 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL9337554 0.83 GAA (0.54) GAACA9CA1CA2CA4
SCHEMBL7288933 0.80 GAA (0.60) GAACA9CA1CA2CA4
SCHEMBL1972988 0.80 GAA (0.60) GAACA9CA1CA2CA4
SCHEMBL2929863 0.78 GAA (0.58) GAACA9CA1CA2CA4
SCHEMBL16797072 0.78 GAA (0.58) GAACA9CA1CA2CA4
SCHEMBL7288937 0.78 GAA (0.58) GAACA9CA1CA2CA4
SCHEMBL10826348 0.77 GAA (0.56) GAACA9CA1CA2CA4
SCHEMBL11331290 0.77 CA2 (0.59) GAACA9CA1CA2CA4
SCHEMBL375690 0.75 GAA (0.54) GAACA9CA1CA2CA4
SCHEMBL9847419 0.75 ALDH1A1 (0.46) GAACA9CA1CA2CA4

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
US-4247559-A N-substituted maleimides in liquid concentrates ABBOTT LABORATORIES (US) 1981-01-27 US disclosed