SCHEMBL7464970

SCHEMBL7464970

CC(C)(C)OC(=O)NCC(=O)NCC(CCCN1CCC(c2ccccc2F)CC1)(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.55
SIGMAR1 Q99720 3/20 0.43
CACNA1G O43497 4/20 0.42
KCNH2 Q12809 1/20 0.42
CCR2 P41597 1/20 0.40
KCNA3 P22001 1/20 0.40
DRD2 P14416 4/20 0.39
OPRL1 P41146 1/20 0.39
DRD4 P21917 1/20 0.39
CCR1 P32246 2/20 0.38
CCR3 P51677 2/20 0.38
PABPC1 P11940 1/20 0.38
CHRM4 P08173 1/20 0.37

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
SCHEMBL7463853 0.95 MCHR1 (0.61) MCHR1SIGMAR1CACNA1GKCNH2KCNA3
SCHEMBL7461074 0.94 MCHR1 (0.54) MCHR1SIGMAR1DRD2CCR1CCR3
SCHEMBL7461814 0.92 MCHR1 (0.54) MCHR1SIGMAR1CACNA1GKCNH2KCNA3
SCHEMBL7466658 0.90 MCHR1 (0.68) MCHR1SIGMAR1CACNA1GCCR2KCNA3
SCHEMBL7460707 0.84 MCHR1 (0.76) MCHR1SIGMAR1CCR2KCNA3DRD2
SCHEMBL7463233 0.83 MCHR1 (0.80) MCHR1DRD4CCR1CCR3CHRM4
Hydrochloric Acid SCHEMBL7465677 0.82 MCHR1 (0.79) MCHR1DRD4CCR1CCR3CHRM4
SCHEMBL7463951 0.82 MCHR1 (0.68) MCHR1SIGMAR1DRD2CCR1CCR3
SCHEMBL7464981 0.81 CACNA1G (0.41) MCHR1CACNA1GKCNH2CCR2DRD2
SCHEMBL7465649 0.80 MCHR1 (0.46) MCHR1DRD2DRD4

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