SCHEMBL4236595

SCHEMBL4236595

CC(C)(C)OC(=O)N1C(Br)=C(N)C=CC1C1CCNCC1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.32
SCN9A Q15858 1/20 0.32
SCN3A Q9NY46 1/20 0.32
SCN5A Q14524 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
NR1H2 P55055 1/20 0.30
PLAT P00750 1/20 0.30

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
SCHEMBL3073015 0.76 GPR119 (0.33) GPR119KDM4EMAPTTHRBNR1H2
SCHEMBL4242556 0.76 MEN1 (0.35) GPR119SCN9ASCN3ASCN5AKDM4E
SCHEMBL6833620 0.73 GPR119 (0.32) GPR119SCN9ASCN3ASCN5AKDM4E
SCHEMBL1420420 0.70 DPP4 (0.32) GPR119SCN9ASCN3ASCN5AKDM4E
SCHEMBL3729459 0.70 GPR119 (0.36) GPR119PLAT
SCHEMBL2039954 0.68 EPHX2 (0.32)
SCHEMBL1847232 0.68 KDM4E (0.32) GPR119SCN9ASCN3ASCN5AKDM4E
SCHEMBL1849221 0.68 LIPE (0.32) GPR119SCN9ASCN3ASCN5APLAT
SCHEMBL1420419 0.67 GPR119 (0.33) GPR119SCN9ASCN3ASCN5AKDM4E
SCHEMBL1847230 0.66 PLAT (0.33) GPR119KDM4EMAPTTHRBNR1H2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2015748-A2 METHOD OF INHIBITING C KIT KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2009-01-21 EP disclosed
EP-1951234-A2 METHOD OF INHIBITING FLT3 KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2008-08-06 EP disclosed
WO-2007124369-A2 METHOD OF INHIBITING C KIT KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-01 WO disclosed
EP-1807077-A2 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-18 EP disclosed
WO-2007048088-A2 METHOD OF INHIBITING FLT3 KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-26 WO disclosed
WO-2006047277-A2 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-04 WO disclosed