SCHEMBL7467263

SCHEMBL7467263

O=C(O)[C@H](NS(=O)(=O)Cc1ccc2sc(F)cc2c1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
HDAC1 Q13547 5/20 0.37
MAPT P10636 1/20 0.35
CA2 P00918 1/20 0.33
EEF2K O00418 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.32
ITGB3 P05106 1/20 0.32
ITGA2B P08514 1/20 0.32
ACP1 P24666 1/20 0.32
MMP12 P39900 2/20 0.32
MMP13 P45452 2/20 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
SCHEMBL6740196 0.90 HDAC1 (0.39) HDAC1
SCHEMBL6740192 0.90 HDAC1 (0.39) HDAC1
SCHEMBL6741909 0.82 CTNNB1 (0.41) SLC1A3SLC1A2SLC1A1HDAC1MAPT
SCHEMBL6733224 0.81 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1CA2MMP13
SCHEMBL6733229 0.81 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1CA2MMP13
SCHEMBL7469686 0.80 SLC1A3 (0.38) SLC1A3SLC1A2SLC1A1MAPTCA2
SCHEMBL12044424 0.76 SLC1A3 (0.59) SLC1A3SLC1A2SLC1A1MAPTCA2
SCHEMBL7059153 0.73 CYP2A6 (0.38) SLC1A3SLC1A2SLC1A1MMP13
SCHEMBL7127966 0.73 ATM (0.35) SLC1A3SLC1A2SLC1A1MAPTCA2
SCHEMBL6738949 0.72 MEP1B (0.41) HDAC1MMP13

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