SCHEMBL11523698

SCHEMBL11523698

CCN(CCNS(C)(=O)=O)c1ccc(NC(=O)OCCS(=O)(=O)c2ccccc2)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
GRK2 P25098 1/20 0.50
DNMT1 P26358 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.50
MAPT P10636 11/20 0.42
MAPK1 P28482 4/20 0.42
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
LMNA P02545 4/20 0.42
HSD17B10 Q99714 2/20 0.42
ALOX15 P16050 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GFER P55789 6/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 4/20 0.39
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
HCRTR1 O43613 1/20 0.39

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
SCHEMBL11525130 0.91 POLB (0.51) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL14079408 0.85 POLB (0.43) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL9818478 0.83 MAPT (0.48) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL11739547 0.80 POLB (0.52) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL14079442 0.78 MAPT (0.52) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL14079444 0.76 HTT (0.51) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL13650233 0.75 MAPT (0.51) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL14079413 0.75 POLB (0.48) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL14079411 0.75 MAPT (0.49) POLBGRK2DNMT1CTDSP1MAPT
SCHEMBL8597482 0.75 MAPT (0.48) POLBGRK2DNMT1CTDSP1MAPT

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
US-4157915-A (2-BENZENESULFONYL)-ETHOXYCARBONYLAMINO-ANILINE COMPOUND AS THE PRECURSOR FUJI PHOTO FILM CO., LTD. (JP) 1979-06-12 US disclosed