SCHEMBL7470101

SCHEMBL7470101

Cc1ccc(C(CCCN2CCC(c3ccccc3)CC2)(CNC(=O)CNC(=O)c2cc3ccccc3[nH]2)c2ccc(C)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.56
SLC6A2 P23975 1/20 0.49
SLC6A4 P31645 1/20 0.49
KDM4E B2RXH2 2/20 0.45
HSD17B10 Q99714 2/20 0.45
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44
CHRNA7 P36544 1/20 0.42
PLD2 O14939 1/20 0.42
ALDH1A1 P00352 1/20 0.42
DRD3 P35462 8/20 0.42
DRD2 P14416 6/20 0.42
HTR2A P28223 4/20 0.42
HTR1A P08908 3/20 0.42
HTR2C P28335 3/20 0.42
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
DRD4 P21917 4/20 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
SCHEMBL7462229 0.95 MCHR1 (0.62) MCHR1SLC6A2SLC6A4KDM4EHSD17B10
SCHEMBL7460423 0.92 MCHR1 (0.56) MCHR1SLC6A2SLC6A4KDM4EHSD17B10
SCHEMBL7461371 0.92 MCHR1 (0.56) MCHR1SLC6A2SLC6A4KDM4EHSD17B10
SCHEMBL7465013 0.92 MCHR1 (0.53) MCHR1DRD3
SCHEMBL7459200 0.90 MCHR1 (0.45) MCHR1SLC6A2SLC6A4KDM4EHSD17B10
SCHEMBL7465486 0.89 DRD4 (0.48) MCHR1SLC6A2SLC6A4KDM4EHSD17B10
SCHEMBL7460142 0.87 MCHR1 (0.56) MCHR1SLC6A2SLC6A4DRD3
SCHEMBL7462536 0.86 MCHR1 (0.58) MCHR1SLC6A2SLC6A4DRD3
SCHEMBL7465415 0.85 MCHR1 (0.56) MCHR1SLC6A2SLC6A4DRD3DRD2
SCHEMBL7459832 0.85 MCHR1 (0.51) MCHR1SLC6A2SLC6A4KDM4EHSD17B10

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
EP-1219294-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed