SCHEMBL7469686

SCHEMBL7469686

O=C(O)[C@H](NS(=O)(=O)Cc1ccc2scc(F)c2c1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
APP P05067 1/20 0.37
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
ITGB3 P05106 1/20 0.34
ITGA2B P08514 1/20 0.34
FFAR1 O14842 3/20 0.34
ULK1 O75385 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
EEF2K O00418 1/20 0.33
CNR1 P21554 2/20 0.32
CMA1 P23946 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32

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
SCHEMBL6734421 0.90 MEP1B (0.39) ULK1HDAC8HDAC6
SCHEMBL6734419 0.90 MEP1B (0.39) ULK1HDAC8HDAC6
SCHEMBL7467263 0.80 SLC1A3 (0.38) SLC1A3SLC1A2SLC1A1MAPTITGB3
SCHEMBL6741909 0.80 CTNNB1 (0.41) SLC1A3SLC1A2SLC1A1MAPTCA1
SCHEMBL12044424 0.76 SLC1A3 (0.59) SLC1A3SLC1A2SLC1A1MAPTITGB3
SCHEMBL6733224 0.76 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1MMP13CA2
SCHEMBL6733229 0.76 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1MMP13CA2
SCHEMBL7526081 0.72 CTNNB1 (0.34) SLC1A3SLC1A2SLC1A1MAPTCA1
SCHEMBL7059153 0.71 CYP2A6 (0.38) SLC1A3SLC1A2SLC1A1MMP13
SCHEMBL6740192 0.71 HDAC1 (0.39) HDAC8HDAC6

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
EP-1244616-A1 (HETERO)BICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES SmithKline Beecham plc (GB) 2002-10-02 EP disclosed
WO-2001047874-A1 (HETERO)BICYCLYMETHANESULFONYLAMINO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES SMITHKLINE BEECHAM P.L.C. (GB) 2001-07-05 WO disclosed