SCHEMBL5359166

SCHEMBL5359166

COC(=O)C1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.52
KDM4E B2RXH2 2/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
GAA P10253 4/20 0.51
POLB P06746 2/20 0.47
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
ALDH1A1 P00352 5/20 0.42
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CASP6 P55212 1/20 0.41
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
APP P05067 1/20 0.39
MMP9 P14780 1/20 0.39
KAT8 Q9H7Z6 1/20 0.39
HTT P42858 1/20 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
SCHEMBL8386526 0.86 MAPT (0.72) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL1715679 0.83 POLB (0.68) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL8003873 0.82 POLB (0.66) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL22670521 0.82 MEN1 (0.62) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL3131292 0.82 POLB (0.66) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL11682423 0.82 POLB (0.50) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL4908008 0.82 GAA (0.72) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL10654200 0.80 POLB (0.58) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL2218027 0.79 KDM4E (0.52) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL14350872 0.79 MAPT (0.52) MAPTKDM4ENPC1RAB9AGAA

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
US-7306632-B2 Leave-in color conditioner HAIRMARKER LLC (US) 2007-12-11 US disclosed
US-20050198746-A1 Leave-in color conditioner HAIRMARKER LLC 2005-09-15 US disclosed