SCHEMBL7464717

SCHEMBL7464717

O=C(CNC(=O)c1cc2ccccc2cc1O)NCC(CCCN1CCC(c2ccccc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.64
MAOB P27338 2/20 0.45
MAOA P21397 1/20 0.45
DRD3 P35462 1/20 0.41
NPC1 O15118 2/20 0.40
KCNA3 P22001 1/20 0.40
RAB9A P51151 1/20 0.39
CCR1 P32246 4/20 0.39
CCR3 P51677 4/20 0.39
HTR7 P34969 3/20 0.39
SLC18A3 Q16572 2/20 0.39
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
SCHEMBL7465464 0.87 MCHR1 (0.63) MCHR1MAOBMAOADRD3KCNA3
SCHEMBL7459547 0.87 MCHR1 (0.65) MCHR1DRD3RAB9AADRA1A
SCHEMBL7464781 0.86 MCHR1 (0.73) MCHR1KCNA3CCR1CCR3HTR7
SCHEMBL7466997 0.85 MCHR1 (0.61) MCHR1DRD3KCNA3CCR1CCR3
SCHEMBL7465382 0.83 MCHR1 (0.62) MCHR1DRD3HTR7ADRA1DADRA1A
SCHEMBL7458838 0.83 MCHR1 (0.65) MCHR1DRD3RAB9AADRA1DADRA1A
SCHEMBL7464932 0.83 MCHR1 (0.62) MCHR1DRD3KCNA3CCR3HTR7
SCHEMBL7462229 0.83 MCHR1 (0.62) MCHR1DRD3
SCHEMBL7470119 0.82 MCHR1 (0.68) MCHR1DRD3KCNA3CCR1CCR3
SCHEMBL7462164 0.82 MCHR1 (0.62) MCHR1DRD3

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