SCHEMBL7863147

SCHEMBL7863147

CCCCCCCCCCCCc1ccc(S(=O)(=O)N(CCO)CCO)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
CNR2 P34972 6/20 0.51
THRA P10827 1/20 0.51
THRB P10828 1/20 0.51
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
CA1 P00915 1/20 0.48
ESR1 P03372 2/20 0.47
ADRA2A P08913 2/20 0.47
ADORA3 P0DMS8 2/20 0.47
TACR2 P21452 2/20 0.47
SLC6A2 P23975 2/20 0.47
SLC6A4 P31645 2/20 0.47
SLC6A3 Q01959 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
SHBG P04278 1/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL9795890 0.91 CA2 (0.60) CA2SMN1; SMN2CNR2THRATHRB
SCHEMBL26313770 0.88 CA2 (0.56) CA2SMN1; SMN2CNR2CA12CA9
SCHEMBL24162766 0.87 CA2 (0.55) CA2SMN1; SMN2CNR2CA12CA9
SCHEMBL10645689 0.83 CA2 (0.62) CA2SMN1; SMN2CNR2CA12CA9
Trolamine SCHEMBL1980906 0.81 CA2 (0.53) CA2SMN1; SMN2THRATHRBCA12
Trolamine SCHEMBL4530093 0.81 CA2 (0.53) CA2SMN1; SMN2THRATHRBCA12
SCHEMBL8626916 0.80 SMN1; SMN2 (0.58) CA2SMN1; SMN2CNR2CA12CA9
Dimethylaminoethanol SCHEMBL14839880 0.80 THRA (0.53) CA2SMN1; SMN2THRATHRBCA12
SCHEMBL7856535 0.80 CA2 (0.62) CA2SMN1; SMN2CNR2THRATHRB
SCHEMBL12040860 0.80 CA2 (0.62) CA2SMN1; SMN2CNR2THRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861210-B1 USE OF SULFONAMIDES FOR CONTROLLING BIOFOULING BUCKMAN LABOR INC (US) 2001-12-12 EP claimed
EP-0861210-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING SULFONAMIDES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-09-02 EP claimed
WO-1997011913-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING SULFONAMIDES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1997-04-03 WO claimed
EP-0861210-B1 USE OF SULFONAMIDES FOR CONTROLLING BIOFOULING BUCKMAN LABOR INC (US) 2001-12-12 EP disclosed
US-6211172-B1 ADHESION PREVENTION OF BACTERIA ON SHIP HULLS BUCKMAN LABORATORIES INTERNATIONAL, INC. 2001-04-03 US disclosed
EP-0861210-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING SULFONAMIDES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-09-02 EP disclosed
WO-1997011913-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING SULFONAMIDES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1997-04-03 WO disclosed