SCHEMBL4066283

SCHEMBL4066283

CC(C)(C)OC(=O)N1CCC(CCN2c3ccccc3N(c3cccc(F)c3F)S2(O)O)CC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.45
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
LIMK2 P53671 1/20 0.43
TGFBR1 P36897 1/20 0.43
MAPT P10636 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
SCHEMBL3600863 0.93 KDM4E (0.46) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL4055717 0.92 KDM4E (0.45) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL4066284 0.91 GPR119 (0.45) GPR119KDM4EPKMTGFBR1MAPT
SCHEMBL4055778 0.87 GPR119 (0.43) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL3608780 0.87 SMN1; SMN2 (0.47) GPR119KDM4EPKMLIMK2MAPT
SCHEMBL4056542 0.87 CHRM2 (0.41) GPR119KDM4EMAPTSMN1; SMN2
SCHEMBL4062687 0.85 GPR119 (0.55) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL4063283 0.85 GPR119 (0.48) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL4055719 0.84 SLC6A2 (0.49) GPR119KDM4EPKMTGFBR1MAPT
SCHEMBL3600866 0.84 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