SCHEMBL4056148

SCHEMBL4056148

CC(C)(C)OC(=O)N1CCOC(CN2c3ccccc3N(c3ccccc3OC(F)(F)F)S2(O)O)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.40
EPHA2 P29317 4/20 0.37
ERBB2 P04626 1/20 0.36
EPHB4 P54760 1/20 0.36
ABHD6 Q9BV23 2/20 0.36
DAGLA Q9Y4D2 1/20 0.36
NR1H4 Q96RI1 1/20 0.35
USP30 Q70CQ3 2/20 0.35
LIPE Q05469 1/20 0.35
CHRM4 P08173 2/20 0.34
BUB1 O43683 1/20 0.34
BCHE P06276 1/20 0.33
HTR6 P50406 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 1/20 0.33
GAA P10253 1/20 0.33
THRB P10828 1/20 0.33
SSTR1 P30872 1/20 0.33
SSTR4 P31391 1/20 0.33
RORC P51449 1/20 0.33

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
SCHEMBL4056151 0.92 SLC6A2 (0.48) SLC6A2EPHA2ERBB2EPHB4ABHD6
SCHEMBL3605773 0.86 SLC6A2 (0.53) SLC6A2EPHA2ERBB2EPHB4USP30
SCHEMBL4062931 0.85 SLC6A2 (0.41) SLC6A2EPHA2ERBB2EPHB4NR1H4
SCHEMBL3604644 0.84 SLC6A2 (0.41) SLC6A2EPHA2USP30BUB1SMN1; SMN2
SCHEMBL3605770 0.79 SLC6A2 (0.67) SLC6A2USP30
SCHEMBL4063320 0.78 SLC6A2 (0.44) SLC6A2EPHA2USP30SMN1; SMN2MAPT
SCHEMBL3604646 0.78 SLC6A2 (0.50) SLC6A2EPHA2SMN1; SMN2MAPTTHRB
SCHEMBL4062934 0.77 SLC6A2 (0.49) SLC6A2SMN1; SMN2MAPT
SCHEMBL4063312 0.73 SLC6A2 (0.53) SLC6A2USP30SMN1; SMN2MAPT
SCHEMBL3600535 0.70 SLC6A2 (0.46) SLC6A2

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