SCHEMBL13664866

SCHEMBL13664866

CC(C)(C)OC(=O)N1CC(=O)N(c2ccc(Cl)c(Cl)c2)CC(F)(F)C1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.49
SLC6A4 P31645 5/20 0.49
SLC6A3 Q01959 3/20 0.49
MAPT P10636 2/20 0.39
GPR119 Q8TDV5 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
USP30 Q70CQ3 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4D Q08499 1/20 0.38
TMEM97 Q5BJF2 1/20 0.38
NOTUM Q6P988 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
ESR2 Q92731 1/20 0.37
NR1H2 P55055 1/20 0.36

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
SCHEMBL13664725 0.88 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3MAPTGPR119
SCHEMBL13664798 0.87 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3MAPTGPR119
SCHEMBL13664724 0.79 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3MAPTGPR119
SCHEMBL13664691 0.75 MAPT (0.50) SLC6A2SLC6A4SLC6A3MAPTGPR119
SCHEMBL26629245 0.74 NR1H2 (0.46) SLC6A2SLC6A4MAPTGPR119SMN1; SMN2
SCHEMBL13664818 0.73 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3MAPTGPR119
SCHEMBL25216200 0.73 MAPT (0.50) MAPTGPR119SMN1; SMN2MAPK1HTT
SCHEMBL31342592 0.72 SUV39H2 (0.44) MAPTGPR119ALDH1A1ESR2NR1H2
SCHEMBL13664895 0.72 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3MAPTSMN1; SMN2
SCHEMBL30208188 0.71 MAPT (0.72) MAPTGPR119SMN1; SMN2MAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009119528-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-10-01 WO disclosed