SCHEMBL4055078

SCHEMBL4055078

CN(CCCN1c2cccc(F)c2N(c2ccccc2)S1(O)O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.35
SLC6A3 Q01959 4/20 0.35
SLC6A4 P31645 3/20 0.35
KCNH2 Q12809 1/20 0.35
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
AMPD2 Q01433 2/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SCN3A Q9NY46 1/20 0.32
TNFSF11 O14788 1/20 0.32
HTR6 P50406 1/20 0.32
LIMK2 P53671 1/20 0.31

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
SCHEMBL4062000 0.92 KDM4E (0.38) SLC6A2SLC6A3SLC6A4KCNH2KDM4E
SCHEMBL4055075 0.90 SLC6A2 (0.43) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4061994 0.86 SLC6A2 (0.43) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4058532 0.85 SLC6A2 (0.42) SLC6A2SLC6A3SLC6A4KCNH2KDM4E
SCHEMBL4053690 0.85 SLC6A2 (0.37) SLC6A2SLC6A3SLC6A4KDM4EL3MBTL1
SCHEMBL4061452 0.84 SLC6A2 (0.35) SLC6A2SLC6A4KDM4EL3MBTL1KMT2A
SCHEMBL4054031 0.81 SLC6A2 (0.52) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4064710 0.80 SLC6A2 (0.40) SLC6A2SLC6A3SLC6A4KCNH2AMPD2
SCHEMBL4056101 0.79 SLC6A2 (0.42) SLC6A2SLC6A3SLC6A4KDM4EL3MBTL1
SCHEMBL4061456 0.78 SLC6A2 (0.41) SLC6A2SLC6A3SLC6A4KCNH2

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-2061776-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE Wyeth a Corporation of the State of Delaware (US) 2009-05-27 EP disclosed
WO-2008073459-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-06-19 WO disclosed