SCHEMBL8512082

SCHEMBL8512082

O=C(O)C(NS(=O)(=O)c1ccc(F)c(F)c1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 2/20 0.60
SLC1A2 P43004 2/20 0.60
SLC1A1 P43005 2/20 0.60
HDAC8 Q9BY41 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
EEF2K O00418 1/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAPT P10636 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
POLB P06746 1/20 0.44
HTR2B P41595 1/20 0.43
PSMD14 O00487 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MMP2 P08253 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
SCHEMBL2013525 0.85 SLC1A3 (0.56) SLC1A3SLC1A2SLC1A1EEF2KMAPT
SCHEMBL10102615 0.82 SLC1A3 (0.56) SLC1A3SLC1A2SLC1A1HDAC8HDAC6
SCHEMBL2053891 0.82 SLC1A3 (0.56) SLC1A3SLC1A2SLC1A1HDAC8HDAC6
SCHEMBL15682748 0.81 SERPINE1 (0.53) SLC1A3SLC1A2SLC1A1HDAC8HDAC6
SCHEMBL15682743 0.81 SERPINE1 (0.53) SLC1A3SLC1A2SLC1A1HDAC8HDAC6
SCHEMBL1000596 0.79 ALDH1A1 (0.62) SLC1A3SLC1A2SLC1A1NPSR1MAPT
SCHEMBL2161085 0.79 ALDH1A1 (0.62) SLC1A3SLC1A2SLC1A1NPSR1MAPT
SCHEMBL2161104 0.79 ALDH1A1 (0.62) SLC1A3SLC1A2SLC1A1NPSR1MAPT
SCHEMBL15387918 0.77 ALDH1A1 (0.53) SLC1A3SLC1A2SLC1A1EEF2KKMT2A
SCHEMBL15387917 0.77 ALDH1A1 (0.53) SLC1A3SLC1A2SLC1A1EEF2KKMT2A

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-2643295-A1 GLYCINE DERIVATIVES AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS Chiesi Farmaceutici S.p.A. (IT) 2013-10-02 EP disclosed
WO-2012069275-A1 GLYCINE DERIVATIVES AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS CHIESI FARMACEUTICI S.P.A. (IT) 2012-05-31 WO disclosed