SCHEMBL10691913

SCHEMBL10691913

CC(C)NCCCNS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.59
ALDH1A1 P00352 8/20 0.54
NPSR1 Q6W5P4 1/20 0.54
LMNA P02545 5/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ADRB2 P07550 2/20 0.49
ADRB1 P08588 2/20 0.49
ADRB3 P13945 2/20 0.49
KDM4E B2RXH2 2/20 0.49
GLA P06280 1/20 0.48
BLM P54132 1/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
GAA P10253 3/20 0.46
ALOX12 P18054 1/20 0.46
MAPK1 P28482 3/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45

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
SCHEMBL9698208 0.91 CYP2C9 (0.62) CYP2C9ALDH1A1NPSR1LMNAMEN1
SCHEMBL14392906 0.82 CYP2C9 (0.71) CYP2C9ALDH1A1LMNAMEN1KMT2A
SCHEMBL4766529 0.81 CA12 (0.61) ALDH1A1SMN1; SMN2CA12CA1CA2
SCHEMBL10692230 0.78 ALDH1A1 (0.65) CYP2C9ALDH1A1NPSR1LMNAKDM4E
SCHEMBL14508938 0.78 CYP2C9 (0.60) CYP2C9ALDH1A1NPSR1LMNAMEN1
SCHEMBL6291291 0.78 ALDH1A1 (0.46) ALDH1A1NPSR1LMNAMEN1KMT2A
SCHEMBL10738787 0.77 MEN1 (0.62) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL10894414 0.77 LMNA (0.53) ALDH1A1NPSR1LMNAMEN1KMT2A
SCHEMBL14101774 0.75 CYP2C9 (0.64) CYP2C9ALDH1A1NPSR1LMNAMEN1
SCHEMBL2011715 0.74 GAA (0.55) ALDH1A1LMNAMEN1KMT2AKDM4E

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