SCHEMBL15423745

SCHEMBL15423745

COc1ccc(Oc2ccc(Oc3ccc(S(=O)(=O)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.73
HTT P42858 2/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
LTA4H P09960 1/20 0.63
GAA P10253 1/20 0.61
PGR P06401 5/20 0.61
MMP2 P08253 4/20 0.60
MMP8 P22894 4/20 0.60
MMP12 P39900 4/20 0.60
MMP13 P45452 4/20 0.60
MMP14 P50281 4/20 0.60
MMP16 P51512 4/20 0.60
MMP9 P14780 3/20 0.60
MMP3 P08254 2/20 0.56
HTR6 P50406 1/20 0.54
SOS1 Q07889 1/20 0.53
LMNA P02545 1/20 0.53
NR3C1 P04150 1/20 0.52
MMP1 P03956 1/20 0.52
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL20129486 1.00 PKM (0.73) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL10672859 0.96 HTT (0.73) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL12091354 0.95 PKM (0.66) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL2900381 0.94 PKM (0.83) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL18069681 0.92 PKM (0.86) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL17472319 0.92 PKM (0.86) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL14148915 0.92 PKM (0.86) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL19008825 0.92 PKM (0.86) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL17827515 0.91 PKM (0.66) PKMHTTSMN1; SMN2LTA4HGAA
SCHEMBL6848913 0.90 HTT (0.74) PKMHTTSMN1; SMN2LTA4HPGR

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
EP-2550335-B1 IMPROVED BLENDS OF POLYARYLENE ETHERS AND POLYARYLENE SULFIDES BASF SE (DE) 2014-01-15 EP disclosed