SCHEMBL28038520

SCHEMBL28038520

CS(=O)(=O)Nc1cccc(N(CCO)CCO)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.63
ALDH1A1 P00352 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.47
NR3C2 P08235 4/20 0.46
HTR7 P34969 2/20 0.46
KEAP1 Q14145 1/20 0.44
KIF11 P52732 1/20 0.43
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL11815759 0.88 NR3C1 (0.81) NR3C1NR3C2HTR7KEAP1
SCHEMBL30280484 0.86 NR3C1 (0.65) NR3C1ALDH1A1SMN1; SMN2POLBNR3C2
SCHEMBL28974174 0.86 NR3C1 (0.65) NR3C1ALDH1A1SMN1; SMN2POLBNR3C2
SCHEMBL29407201 0.83 NR3C1 (0.68) NR3C1ALDH1A1SMN1; SMN2POLBNR3C2
SCHEMBL5945125 0.83 NR3C1 (0.68) NR3C1ALDH1A1SMN1; SMN2POLBNR3C2
Hydrochloric Acid SCHEMBL11059615 0.81 NR3C1 (0.67) NR3C1ALDH1A1SMN1; SMN2POLBNR3C2
SCHEMBL11701347 0.81 NR3C1 (0.55) NR3C1ALDH1A1SMN1; SMN2POLBNR3C2
SCHEMBL28038527 0.81 NR3C2 (0.51) ALDH1A1SMN1; SMN2NR3C2KEAP1KIF11
SCHEMBL11670069 0.80 NR3C1 (0.61) NR3C1ALDH1A1SMN1; SMN2POLBNR3C2
SCHEMBL10808735 0.79 HRH3 (0.40) NR3C1ALDH1A1SMN1; SMN2POLBKDM4E

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
CN-104955358-A Kit for coloring hair UNILEVER NV 2015-09-30 CN disclosed