SCHEMBL7258181

SCHEMBL7258181

CC(=O)C1CNCCN1c1ccc(NS(=O)(=O)O)cc1.c1cc2ccc1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 2/20 0.43
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HTR6 P50406 1/20 0.35
MMP1 P03956 2/20 0.34
MMP9 P14780 2/20 0.34
MMP13 P45452 2/20 0.34
MMP3 P08254 1/20 0.34
MMP7 P09237 1/20 0.34
HRH3 Q9Y5N1 2/20 0.33
GFER P55789 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
POLB P06746 2/20 0.32
PORCN Q9H237 2/20 0.32
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSS P25774 1/20 0.31
F13A1 P00488 1/20 0.31
TGM2 P21980 1/20 0.31

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
SCHEMBL10683759 0.87 ADRB1 (0.56) ADRB1SLC6A2SLC6A4SLC6A3HTR6
SCHEMBL11076879 0.80 HTR3E (0.41) ADRB1
SCHEMBL21382496 0.74 SLC6A2 (0.34) ADRB1SLC6A2SLC6A4SLC6A3MMP1
SCHEMBL23244311 0.72 PKM (0.42) SLC6A4SLC6A3
SCHEMBL7258296 0.70 ADRB1 (0.48) ADRB1SLC6A2SLC6A4SLC6A3HTR6
SCHEMBL846305 0.69 NPC1 (0.53)
SCHEMBL9052450 0.67 MMP1 (0.34) MMP1MMP9MMP13MMP3MMP7
SCHEMBL28295939 0.66 MAPT (0.50) SLC6A2SLC6A4SLC6A3GFERL3MBTL1
SCHEMBL1811425 0.66 SLC6A2 (0.37) ADRB1SLC6A2SLC6A4SLC6A3
SCHEMBL7262930 0.65 HTR2C (0.44) SLC6A2SLC6A4SLC6A3

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
WO-2003082263-A1 SULFAMIC ACIDS AS INHIBITORS OF HUMAN CYTOPLASMIC PROTEIN TYROSINE PHOSPHATASES ONTOGEN CORPORATION (US) 2003-10-09 WO disclosed