SCHEMBL4055780

SCHEMBL4055780

CC(C)(C)OC(=O)N1CCC(CCN2c3ccccc3N(c3cc(F)ccc3F)S2(=O)=O)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.52
SLC6A3 Q01959 5/20 0.52
KCNH2 Q12809 1/20 0.52
SLC6A4 P31645 3/20 0.45
GPR119 Q8TDV5 8/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL3608226 0.93 SLC6A2 (0.52) SLC6A2SLC6A3KCNH2SLC6A4GPR119
SCHEMBL3600866 0.92 SLC6A2 (0.48) SLC6A2SLC6A3SLC6A4GPR119KDM4E
SCHEMBL4055778 0.91 GPR119 (0.43) SLC6A2SLC6A3GPR119KDM4EPKM
SCHEMBL4059631 0.87 SLC6A2 (0.51) SLC6A2SLC6A3KCNH2SLC6A4GPR119
SCHEMBL4066284 0.87 GPR119 (0.45) SLC6A2SLC6A3SLC6A4GPR119KDM4E
SCHEMBL4055719 0.86 SLC6A2 (0.49) SLC6A2SLC6A3KCNH2SLC6A4GPR119
SCHEMBL4062683 0.84 GPR119 (0.55) SLC6A2SLC6A3KCNH2SLC6A4GPR119
SCHEMBL3608780 0.84 SMN1; SMN2 (0.47) GPR119KDM4EPKMSMN1; SMN2
SCHEMBL3600863 0.82 KDM4E (0.46) GPR119KDM4EPKMSMN1; SMN2
SCHEMBL4063277 0.80 GPR119 (0.48) SLC6A2SLC6A4GPR119KDM4EPKM

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