SCHEMBL7465464

SCHEMBL7465464

O=C(CNC(=O)c1ccc2ccccc2c1O)NCC(CCCN1CCC(c2ccccc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.63
HTR7 P34969 4/20 0.44
DRD3 P35462 1/20 0.42
BCHE P06276 1/20 0.42
KCNA3 P22001 1/20 0.39
CCR3 P51677 4/20 0.39
MAOB P27338 2/20 0.39
MAOA P21397 1/20 0.39
CCR1 P32246 3/20 0.39
CCR5 P51681 1/20 0.39
DRD4 P21917 1/20 0.38
ADRA1D P25100 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 1/20 0.38

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
SCHEMBL7464717 0.87 MCHR1 (0.64) MCHR1HTR7DRD3KCNA3CCR3
SCHEMBL7464781 0.85 MCHR1 (0.73) MCHR1HTR7KCNA3CCR3CCR1
SCHEMBL7459547 0.85 MCHR1 (0.65) MCHR1DRD3DRD4ADRA1A
SCHEMBL7462164 0.84 MCHR1 (0.62) MCHR1DRD3DRD4
SCHEMBL7466997 0.83 MCHR1 (0.61) MCHR1HTR7DRD3BCHEKCNA3
SCHEMBL7470119 0.82 MCHR1 (0.68) MCHR1HTR7DRD3KCNA3CCR3
SCHEMBL7467493 0.81 MCHR1 (0.61) MCHR1HTR7DRD3CCR1ADRA1A
SCHEMBL7464932 0.81 MCHR1 (0.62) MCHR1HTR7DRD3BCHEKCNA3
SCHEMBL7462229 0.81 MCHR1 (0.62) MCHR1DRD3DRD4
SCHEMBL7465382 0.81 MCHR1 (0.62) MCHR1HTR7DRD3DRD4ADRA1D

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