SCHEMBL7367756

SCHEMBL7367756

N#Cc1ccc(NS(=O)(=O)c2cccc(-c3nc4cccc([N+](=O)[O-])c4[nH]3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 1/20 0.47
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45
ATIC P31939 2/20 0.43
MAPT P10636 5/20 0.43
TP53 P04637 2/20 0.43
HSPD1 P10809 4/20 0.42
PTPN2 P17706 4/20 0.42
PTPN1 P18031 4/20 0.42
PTPN5 P54829 4/20 0.42
HSPE1 P61604 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL7370197 0.92 MMP2 (0.48) MAP2K4MMP2MMP9MMP8MMP13
SCHEMBL7369834 0.88 MAPT (0.47) MAP2K4MMP2MMP9MMP8MMP13
SCHEMBL7372182 0.84 MMP2 (0.49) MMP2MMP9MMP8MMP13MAPT
SCHEMBL7375348 0.81 NPC1 (0.49) MMP2MMP9MMP8MMP13MAPT
SCHEMBL7376435 0.80 MEN1 (0.50) MAPTTP53SMN1; SMN2MEN1ALDH1A1
SCHEMBL7371315 0.77 PTPN2 (0.54) MAP2K4MAPTHSPD1PTPN2PTPN1
SCHEMBL7372718 0.76 MAPT (0.44) MMP2MMP9MMP8MMP13MAPT
SCHEMBL7370125 0.76 MAPT (0.49) MMP2MMP9MMP8MMP13MAPT
SCHEMBL6925701 0.74 MAPT (0.62) MAP2K4MMP2MMP9MMP8MMP13
SCHEMBL16147276 0.73 MMP2 (0.78) MMP2MMP9MMP8MMP13ATIC

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
WO-2001074786-A1 HETEROBIARYLSULPHONAMIDES AND THEIR USE AS PDE 7 INHIBITORS DARWIN DISCOVERY LIMITED (GB) 2001-10-11 WO claimed
WO-2001074786-A1 HETEROBIARYLSULPHONAMIDES AND THEIR USE AS PDE 7 INHIBITORS DARWIN DISCOVERY LIMITED (GB) 2001-10-11 WO disclosed