SCHEMBL4055778

SCHEMBL4055778

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

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
LIMK2 P53671 1/20 0.42
TGFBR1 P36897 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL3608780 0.93 SMN1; SMN2 (0.47) GPR119KDM4EPKMLIMK2SMN1; SMN2
SCHEMBL3600863 0.92 KDM4E (0.46) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL4055780 0.91 SLC6A2 (0.52) GPR119KDM4EPKMMEN1KMT2A
SCHEMBL4059629 0.87 PLK1 (0.43) GPR119SMN1; SMN2SLC6A2SLC6A3
SCHEMBL4066283 0.87 GPR119 (0.45) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL4055717 0.86 KDM4E (0.45) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL4062687 0.84 GPR119 (0.55) GPR119KDM4EPKMLIMK2TGFBR1
SCHEMBL3608226 0.84 SLC6A2 (0.52) GPR119SMN1; SMN2SLC6A2SLC6A3
SCHEMBL3600866 0.82 SLC6A2 (0.48) GPR119KDM4EPKMSMN1; SMN2SLC6A2
SCHEMBL4063283 0.80 GPR119 (0.48) GPR119KDM4EPKMLIMK2TGFBR1

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