SCHEMBL7724402

SCHEMBL7724402

CCCc1ccccc1OS(=O)(=O)Oc1ccccc1CCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA5A P35218 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
PPARD Q03181 1/20 0.41
HTR1A P08908 2/20 0.41
ADRA2A P08913 2/20 0.41
ADRA2B P18089 2/20 0.41
ADRA2C P18825 2/20 0.41
NISCH Q9Y2I1 1/20 0.41
DHODH Q02127 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
AR P10275 1/20 0.40
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
SLC6A2 P23975 2/20 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
SCHEMBL11791849 0.87 THRA (0.52) CA1CA2CA9THRATHRB
SCHEMBL8288339 0.87 TAAR1 (0.43) CA12CA1CA2CA5ACA9
SCHEMBL8990370 0.86 THRA (0.55) THRATHRB
SCHEMBL8990627 0.86 THRA (0.55) THRATHRB
SCHEMBL11654900 0.86 THRA (0.55) THRATHRB
SCHEMBL6838738 0.86 THRA (0.55) THRATHRB
SCHEMBL777281 0.86 L3MBTL1 (0.50) CA12CA1CA2CA5ACA9
SCHEMBL7724404 0.85 PPARD (0.43) CA12CA1CA2CA5ACA9
SCHEMBL16127297 0.85 CA2 (0.47) CA12CA1CA2CA5ACA9
SCHEMBL29617961 0.84 THRA (0.54) THRATHRB

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-6395825-B1 REACTING TETRACHLOROSILANE OR A TRICHLOROSILANE IN MIXTURE COMPRISING HYDROCHLORIC ACID, NON-POLAR SOLVENT AND ORGANIC SULFATE; COATINGS, PROTECTIVE BARRIERS, ELECTRONICS DOW CORNING CORPORATION 2002-05-28 US disclosed