SCHEMBL7460423

SCHEMBL7460423

O=C(CNC(=O)c1cc2ccccc2[nH]1)NCC(CCCN1CCC(c2ccccc2)CC1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.56
SLC6A2 P23975 1/20 0.49
SLC6A4 P31645 1/20 0.49
DRD3 P35462 5/20 0.47
KDM4E B2RXH2 2/20 0.45
HSD17B10 Q99714 2/20 0.45
CCR1 P32246 3/20 0.44
DRD2 P14416 3/20 0.43
HTR2A P28223 2/20 0.43
DRD4 P21917 1/20 0.43
CHRNA7 P36544 1/20 0.42
CCR3 P51677 3/20 0.42
PRCP P42785 2/20 0.42
PLD2 O14939 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HTR1A P08908 1/20 0.42
HTR2C P28335 1/20 0.42

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
SCHEMBL7460142 0.95 MCHR1 (0.56) MCHR1SLC6A2SLC6A4DRD3CCR1
SCHEMBL7462229 0.95 MCHR1 (0.62) MCHR1SLC6A2SLC6A4DRD3KDM4E
SCHEMBL7465415 0.93 MCHR1 (0.56) MCHR1SLC6A2SLC6A4DRD3CCR1
SCHEMBL7461371 0.92 MCHR1 (0.56) MCHR1SLC6A2SLC6A4DRD3KDM4E
SCHEMBL7462536 0.92 MCHR1 (0.58) MCHR1SLC6A2SLC6A4DRD3CCR1
SCHEMBL7470101 0.92 MCHR1 (0.56) MCHR1SLC6A2SLC6A4DRD3KDM4E
SCHEMBL7467819 0.92 MCHR1 (0.53) MCHR1SLC6A2SLC6A4DRD3CCR1
SCHEMBL7461458 0.91 MCHR1 (0.53) MCHR1DRD3CCR1DRD2CCR3
SCHEMBL7465013 0.91 MCHR1 (0.53) MCHR1DRD3
SCHEMBL7463222 0.90 MCHR1 (0.53) MCHR1DRD3KDM4ECCR1DRD2

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