SCHEMBL8320723

SCHEMBL8320723

CS(=O)(=O)c1ccc(S(=O)(=O)N2[C@@H](C(=O)O)C[C@H]3CCC[C@H]32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
ALDH1A1 P00352 4/20 0.42
HTT P42858 2/20 0.42
EPHX2 P34913 1/20 0.42
ATM Q13315 1/20 0.41
ACHE P22303 5/20 0.41
TDP1 Q9NUW8 1/20 0.41
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MMP2 P08253 1/20 0.38

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
SCHEMBL2964063 1.00 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2953994 0.90 ACHE (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8319711 0.87 ALDH1A1 (0.58) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2969335 0.87 ALDH1A1 (0.58) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8327403 0.87 TDP1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8320725 0.87 EPHX2 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2969395 0.87 TDP1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8320747 0.87 TDP1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3148192 0.87 ACHE (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8324754 0.86 MMP2 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772270-B2 Imino acid derivatives as inhibitors of matrix metalloproteinases SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-08-10 US disclosed
US-7772270-B2 Imino acid derivatives as inhibitors of matrix metalloproteinases SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-08-10 US disclosed
EP-1585728-B1 IMINO ACID DERIVATIVES FOR USE AS INHIBITORS OF MATRIX METALLOPROTEINASES SANOFI AVENTIS DEUTSCHLAND (DE) 2010-02-24 EP disclosed
WO-2004060874-A1 IMINO ACID DERIVATIVES FOR USE AS INHIBITORS OF MATRIX METALLOPROTEINASES AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-07-22 WO disclosed