SCHEMBL11569813

SCHEMBL11569813

CC(=O)c1ccc(OS(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.68
KMT2A Q03164 4/20 0.68
ENPP1 P22413 5/20 0.61
ENPP3 O14638 4/20 0.61
ENPP2 Q13822 3/20 0.61
TDP1 Q9NUW8 1/20 0.60
STS P08842 1/20 0.56
MAPT P10636 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.52
RAB9A P51151 2/20 0.47
HPGD P15428 1/20 0.47
ALPL P05186 1/20 0.47
ALPI P09923 1/20 0.47
NPC1 O15118 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL7824336 0.85 TDP1 (0.67) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL4325565 0.85 KMT2A (0.70) MEN1KMT2AENPP1ENPP3ENPP2
Chlorfenson SCHEMBL7194888 0.84 TDP1 (0.81) MEN1KMT2AENPP1ENPP3ENPP2
Chlorfenson SCHEMBL116752 0.84 TDP1 (0.81) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL4321286 0.84 MEN1 (0.68) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL687294 0.83 KMT2A (0.72) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL28490431 0.83 KMT2A (0.72) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL4321339 0.81 MEN1 (0.83) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL13578628 0.80 MEN1 (0.63) MEN1KMT2AENPP1ENPP3ENPP2
SCHEMBL15121509 0.80 TDP1 (0.68) MEN1KMT2AENPP1ENPP3ENPP2

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-0001495-A1 Peroxygen bleaching and compositions therefor FMC Corporation (US) 1979-04-18 EP disclosed
US-4128490-A BLEACHES FMC CORPORATION (US) 1978-12-05 US disclosed