SCHEMBL7464640

SCHEMBL7464640

O=CNCC(CCCN1CCC(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.53
CCR3 P51677 10/20 0.47
CCR1 P32246 7/20 0.47
DRD2 P14416 1/20 0.46
ADRB2 P07550 1/20 0.45
ADRA2A P08913 1/20 0.45
KCNA3 P22001 1/20 0.45
PARP1 P09874 1/20 0.45
CCR2 P41597 1/20 0.45
CX3CR1 P49238 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
Hydrochloric Acid SCHEMBL7465064 0.99 MCHR1 (0.52) MCHR1CCR3CCR1DRD2ADRB2
SCHEMBL7462064 0.97 MCHR1 (0.54) MCHR1CCR3CCR1KCNA3MEN1
Hydrochloric Acid SCHEMBL7458878 0.96 MCHR1 (0.54) MCHR1CCR3CCR1KCNA3CX3CR1
SCHEMBL7463216 0.92 MCHR1 (0.60) MCHR1DRD2KCNA3MEN1KMT2A
Hydrochloric Acid SCHEMBL7469999 0.91 MCHR1 (0.59) MCHR1DRD2KCNA3MEN1KMT2A
SCHEMBL7464873 0.88 MCHR1 (0.56) MCHR1CCR3CCR1DRD2KCNA3
SCHEMBL7466786 0.84 MCHR1 (0.54) MCHR1CCR3CCR1DRD2KCNA3
Hydrochloric Acid SCHEMBL7464242 0.83 MCHR1 (0.54) MCHR1CCR3CCR1DRD2KCNA3
SCHEMBL7459803 0.82 CHRM4 (0.50) CCR3CCR1DRD2KCNA3
Hydrochloric Acid SCHEMBL8869803 0.81 CHRM4 (0.52) CCR3CCR1DRD2KCNA3

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