SCHEMBL4554504

SCHEMBL4554504

Cc1nn(C)c(-n2ccc3ccc(Cl)cc32)c1CC(CC1CC1)S(=O)(=O)OC(N)=O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 2/20 0.35
FPR2 P25090 2/20 0.31
PROKR1 Q8TCW9 2/20 0.31
KMO O15229 1/20 0.31

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
SCHEMBL4554651 0.94 NPY5R (0.34) NPY5RFPR2PROKR1
SCHEMBL4554437 0.89 MAPK8 (0.32) KMO
SCHEMBL4553761 0.87 MAPK8 (0.31) KMO
SCHEMBL4555121 0.83 MAPK8 (0.35)
SCHEMBL4554506 0.83 NPY5R (0.38) NPY5RFPR2PROKR1KMO
SCHEMBL4554738 0.81 MAPK8 (0.33)
SCHEMBL4553442 0.81 MEN1 (0.41)
SCHEMBL4553882 0.81 IRAK4 (0.33)
SCHEMBL4554827 0.79 OXER1 (0.31)
SCHEMBL4554653 0.77 NPY5R (0.38) NPY5RFPR2PROKR1

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-2118066-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA Takeda Pharmaceutical Company Limited (JP) 2009-11-18 EP disclosed
WO-2008099794-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-21 WO disclosed