SCHEMBL3698657

SCHEMBL3698657

Cc1ccc(S(=O)(=O)OCCOCC2(C)COC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
ALDH1A1 P00352 3/20 0.37
STAT3 P40763 1/20 0.35
PTGS2 P35354 1/20 0.34
KMT2A Q03164 3/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
PKM P14618 1/20 0.34
CYP24A1 Q07973 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
MEN1 O00255 1/20 0.33
VDR P11473 1/20 0.33
AOC2 O75106 1/20 0.32

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
SCHEMBL277105 0.87 KMT2A (0.41) CA12CA1CA9ALDH1A1STAT3
SCHEMBL19106783 0.84 CA12 (0.41) CA12CA1CA9ALDH1A1STAT3
SCHEMBL7814512 0.81 KMT2A (0.39) CA12CA1CA9ALDH1A1STAT3
SCHEMBL18644929 0.80 ALDH1A1 (0.53) CA12CA1CA9ALDH1A1STAT3
SCHEMBL18613994 0.80 ALDH1A1 (0.53) CA12CA1CA9ALDH1A1STAT3
SCHEMBL922407 0.80 ALDH1A1 (0.53) CA12CA1CA9ALDH1A1STAT3
SCHEMBL4379133 0.80 ALDH1A1 (0.53) CA12CA1CA9ALDH1A1STAT3
SCHEMBL478342 0.80 ALDH1A1 (0.53) CA12CA1CA9ALDH1A1STAT3
SCHEMBL881292 0.80 ALDH1A1 (0.53) CA12CA1CA9ALDH1A1STAT3
SCHEMBL1145153 0.80 ALDH1A1 (0.53) CA12CA1CA9ALDH1A1STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842388-B2 Functional polymers via surface modifying agents VIRGINIA COMMONWEALTH UNIVERSITY (US) 2010-11-30 US disclosed
US-7842388-B2 Functional polymers via surface modifying agents VIRGINIA COMMONWEALTH UNIVERSITY (US) 2010-11-30 US disclosed
US-7842388-B2 Functional polymers via surface modifying agents VIRGINIA COMMONWEALTH UNIVERSITY (US) 2010-11-30 US disclosed
US-7771793-B2 Functional polymers via surface modifying agents, and methods for polymeric surface modification VIRGINIA COMMONWEALTH UNIVERSITY (US) 2010-08-10 US disclosed
US-7771793-B2 Functional polymers via surface modifying agents, and methods for polymeric surface modification VIRGINIA COMMONWEALTH UNIVERSITY (US) 2010-08-10 US disclosed
US-7771793-B2 Functional polymers via surface modifying agents, and methods for polymeric surface modification VIRGINIA COMMONWEALTH UNIVERSITY (US) 2010-08-10 US disclosed
US-20060194065-A1 Functional polymers via surface modifying agents, and methods for polymeric surface modification THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY 2006-08-31 US disclosed
US-20060154083-A1 Functional polymers via surface modifying agents, and methods for polymeric surface modification THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY 2006-07-13 US disclosed