SCHEMBL10693476

SCHEMBL10693476

CC(C)N(CCN(C(C)C)S(=O)(=O)c1ccc(NS(=O)(=O)C(F)(F)F)cc1)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.49
PTPN11 Q06124 1/20 0.46
CA1 P00915 5/20 0.45
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTPN1 P18031 1/20 0.43
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
KIF11 P52732 1/20 0.37
ALDH1A1 P00352 2/20 0.36
PRMT6 Q96LA8 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
SCHEMBL10702228 0.84 MEN1 (0.55) CA2PTPN11CA1MAPK1SMN1; SMN2
SCHEMBL9834718 0.83 RORC (0.46) CA2CA1MAPK1SMN1; SMN2HTT
SCHEMBL10694255 0.79 ALDH1A1 (0.59) CA2PTPN11CA1MAPK1SMN1; SMN2
SCHEMBL10773767 0.76 HTT (0.64) CA2CA1HTTMEN1LMNA
SCHEMBL10679045 0.74 GAA (0.42) CA2CA1LMNAALDH1A1
SCHEMBL10693087 0.74 TDP1 (0.46) MAPK1HTTALDH1A1
SCHEMBL7525890 0.70 CA2 (0.68) CA2PTPN11CA1MAPK1SMN1; SMN2
SCHEMBL9835822 0.69 CYP2C9 (0.46) CA2CA1MAPK1SMN1; SMN2HTT
SCHEMBL7208755 0.69 PTPN11 (0.61) CA2PTPN11CA1MAPK1SMN1; SMN2
Risotilide SCHEMBL123045 0.68 TRPV4 (0.49) CA2CA1MAPK1SMN1; SMN2HTT

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-0260901-A1 Benzenesulphonamides useful as anti-arrythmic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1988-03-23 EP claimed
US-4721809-A Alkylsulfonamido or perfluoroalkylsulfonamido benzenesulfonamides AMERICAN HOME PRODUCTS CORPORATION (US) 1988-01-26 US claimed
US-4721809-A Alkylsulfonamido or perfluoroalkylsulfonamido benzenesulfonamides AMERICAN HOME PRODUCTS CORPORATION (US) 1988-01-26 US disclosed