SCHEMBL7369834

SCHEMBL7369834

O=[N+]([O-])c1cccc2nc(-c3cccc(S(=O)(=O)Nc4ccc(Cl)cc4)c3)[nH]c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
MMP13 P45452 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HSPD1 P10809 4/20 0.46
PTPN2 P17706 4/20 0.46
PTPN1 P18031 4/20 0.46
HSPE1 P61604 4/20 0.46
PTPN5 P54829 3/20 0.46
CHEK2 O96017 1/20 0.45
TP53 P04637 3/20 0.45
MAP2K4 P45985 1/20 0.44
PGR P06401 1/20 0.43
PLCG2 P16885 1/20 0.43

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
SCHEMBL7372182 0.92 MMP2 (0.49) MAPTMEN1KMT2AMMP2MMP9
SCHEMBL7367756 0.88 MAP2K4 (0.47) MAPTMEN1KMT2AMMP2MMP9
SCHEMBL7372718 0.86 MAPT (0.44) MAPTMEN1KMT2AMMP2MMP9
SCHEMBL7375348 0.83 NPC1 (0.49) MAPTMEN1KMT2AMMP2MMP9
SCHEMBL7370197 0.83 MMP2 (0.48) MAPTMMP2MMP9MMP8MMP13
SCHEMBL7376435 0.82 MEN1 (0.50) MAPTMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL7370125 0.82 MAPT (0.49) MAPTMEN1KMT2AMMP2MMP9
SCHEMBL1895139 0.73 MEN1 (0.56) MAPTMEN1KMT2AMMP2MMP9
SCHEMBL5228114 0.71 ALDH1A1 (0.71) MAPTMEN1KMT2AMMP2MMP9
SCHEMBL4249469 0.71 MMP2 (0.86) MAPTMEN1KMT2AMMP2MMP9

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