SCHEMBL5153447

SCHEMBL5153447

CCCc1ccc(S(=O)(=O)c2cc(O)c(O)c(O)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.56
SMN1; SMN2 Q16637 1/20 0.45
HTR6 P50406 1/20 0.45
CNR2 P34972 2/20 0.44
CNR1 P21554 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
MCL1 Q07820 1/20 0.42
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41

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
SCHEMBL9646586 0.87 CA2 (0.56) CA2SMN1; SMN2CNR2CNR1FFAR4
SCHEMBL5153902 0.86 CA2 (0.53) CA2HTR6ALDH1A1MEN1LMNA
SCHEMBL11889489 0.84 CA2 (0.69) CA2SMN1; SMN2HTR6CNR2FFAR4
SCHEMBL9645863 0.78 CA2 (0.58) CA2SMN1; SMN2ALDH1A1CA12CA1
SCHEMBL4618112 0.77 HTR6 (0.67) CA2SMN1; SMN2HTR6CNR2FFAR4
SCHEMBL5153485 0.77 GAA (0.64) CA2SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL16352317 0.77 GAA (0.64) CA2SMN1; SMN2HTR6CNR2FFAR4
SCHEMBL9231535 0.75 CA2 (0.63) CA2SMN1; SMN2HTR6FFAR4ALDH1A1
SCHEMBL4615671 0.75 CA2 (0.58) CA2SMN1; SMN2HTR6FFAR4ALDH1A1
SCHEMBL5157374 0.75 TSHR (0.47) CA2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1245403-B1 Thermographic recording material with improved image tone. AGFA GEVAERT (BE) 2007-01-03 EP disclosed
US-6774084-B2 BLACK AND WHITE LIGHT-INSENSITIVE THERMOGRAPHIC RECORDING MEDIA COMPRISING A THERMOSENSITIVE ELEMENT HAVING ORGANIC SILVER SALT, A 1,2-DIHYDROXYBENZENE CONTAINING AN ESTER OR SULFOXIDE GROUP AND BINDER; COVERING POWER; STORAGE STABILITY AGFA-GEVAERT (BE) 2004-08-10 US disclosed