SCHEMBL7465382

SCHEMBL7465382

O=C(CNC(=O)c1cc2ccccc2s1)NCC(CCCN1CCC(c2ccccc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.62
SLC6A4 P31645 5/20 0.52
SLC6A2 P23975 4/20 0.52
DRD2 P14416 13/20 0.47
DRD3 P35462 10/20 0.47
HTR1A P08908 4/20 0.43
HTR2A P28223 4/20 0.43
HTR7 P34969 2/20 0.43
PLD2 O14939 1/20 0.43
PLD1 Q13393 1/20 0.43
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
ACKR3 P25106 1/20 0.42
HTR2C P28335 3/20 0.42
HRH1 P35367 1/20 0.42
DRD4 P21917 4/20 0.42
DRD1 P21728 2/20 0.42
ADRA1D P25100 2/20 0.42
ADRA1A P35348 2/20 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
SCHEMBL7464781 0.84 MCHR1 (0.73) MCHR1DRD2HTR7
SCHEMBL7459547 0.84 MCHR1 (0.65) MCHR1SLC6A4SLC6A2DRD2DRD3
SCHEMBL7464717 0.83 MCHR1 (0.64) MCHR1DRD3HTR7ADRA1DADRA1A
SCHEMBL7462229 0.82 MCHR1 (0.62) MCHR1SLC6A4SLC6A2DRD2DRD3
SCHEMBL7458838 0.82 MCHR1 (0.65) MCHR1SLC6A4SLC6A2DRD2DRD3
SCHEMBL7464932 0.82 MCHR1 (0.62) MCHR1DRD2DRD3HTR1AHTR2A
SCHEMBL7470119 0.81 MCHR1 (0.68) MCHR1SLC6A4SLC6A2DRD2DRD3
SCHEMBL7465464 0.81 MCHR1 (0.63) MCHR1DRD3HTR7DRD4ADRA1D
SCHEMBL7460278 0.80 MCHR1 (0.71) MCHR1HTR7ADRA1DADRA1AADRA1B
SCHEMBL7463521 0.80 MCHR1 (0.66) MCHR1HTR7PLD2PLD1ADRA1D

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