SCHEMBL4055717

SCHEMBL4055717

CC(C)(C)OC(=O)N1CCC(CCN2c3ccccc3N(c3c(F)cccc3F)S2(O)O)CC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
PKM P14618 1/20 0.45
TGFBR1 P36897 1/20 0.44
GPR119 Q8TDV5 12/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LIMK2 P53671 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 0.92 KDM4E (0.46) KDM4EPKMTGFBR1GPR119MAPT
SCHEMBL4066283 0.92 GPR119 (0.45) KDM4EPKMTGFBR1GPR119MAPT
SCHEMBL4055719 0.91 SLC6A2 (0.49) KDM4EPKMTGFBR1GPR119MAPT
SCHEMBL4063283 0.90 GPR119 (0.48) KDM4EPKMTGFBR1GPR119MAPT
SCHEMBL4056334 0.87 CHRM2 (0.42) KDM4EGPR119MAPTSMN1; SMN2
SCHEMBL4062687 0.86 GPR119 (0.55) KDM4EPKMTGFBR1GPR119LIMK2
SCHEMBL4055778 0.86 GPR119 (0.43) KDM4EPKMTGFBR1GPR119SMN1; SMN2
SCHEMBL3608780 0.86 SMN1; SMN2 (0.47) KDM4EPKMGPR119MAPTSMN1; SMN2
SCHEMBL3600866 0.85 SLC6A2 (0.48) KDM4EPKMGPR119MAPTSMN1; SMN2
SCHEMBL4066284 0.84 GPR119 (0.45) KDM4EPKMTGFBR1GPR119MAPT

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