SCHEMBL4064084

SCHEMBL4064084

CC(C)(C)OC(=O)N1CCC(CN2c3cccc(F)c3N(c3ccccc3)S2(=O)=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.47
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TGFBR1 P36897 2/20 0.41
TP53 P04637 2/20 0.41
THRB P10828 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RORC P51449 1/20 0.40
STS P08842 1/20 0.39

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
SCHEMBL4063277 0.92 GPR119 (0.48) GPR119KDM4EPKMMAPTSMN1; SMN2
SCHEMBL4064088 0.91 GPR119 (0.47) GPR119KDM4EPKMMAPTSMN1; SMN2
SCHEMBL4059662 0.88 GPR119 (0.53) GPR119KDM4EPKMSMN1; SMN2TGFBR1
SCHEMBL4063283 0.85 GPR119 (0.48) GPR119KDM4EPKMMAPTSMN1; SMN2
SCHEMBL4054208 0.84 GPR119 (0.41) GPR119TP53THRB
SCHEMBL4055719 0.81 SLC6A2 (0.49) GPR119KDM4EPKMMAPTSMN1; SMN2
SCHEMBL4059665 0.80 GPR119 (0.53) GPR119KDM4EPKMSMN1; SMN2TGFBR1
SCHEMBL4062683 0.79 GPR119 (0.55) GPR119KDM4EPKM
SCHEMBL4063156 0.78 GPR119 (0.51) GPR119KDM4EPKM
SCHEMBL3600866 0.77 SLC6A2 (0.48) GPR119KDM4EPKMMAPTSMN1; SMN2

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