SCHEMBL7470794

SCHEMBL7470794

N#CC(CCCN1CCC(c2ccccc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.85

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 4/20 0.85
CCR3 P51677 3/20 0.70
CCR1 P32246 7/20 0.57
SIGMAR1 Q99720 1/20 0.55
RAB9A P51151 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54

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
SCHEMBL11712812 0.92 KCNA3 (1.00) KCNA3CCR3CCR1SIGMAR1RAB9A
SCHEMBL7526133 0.92 KCNA3 (0.72) KCNA3CCR3CCR1
SCHEMBL9103936 0.85 KCNA3 (0.85) KCNA3CCR3CCR1
SCHEMBL904831 0.80 CCR3 (0.64) KCNA3CCR3CCR1RAB9ANPSR1
SCHEMBL904837 0.80 ADRA1D (0.62) KCNA3CCR3
SCHEMBL904843 0.79 CCR3 (0.56) KCNA3CCR3CCR1
SCHEMBL904913 0.79 CCR3 (0.56) KCNA3CCR3CCR1
SCHEMBL904841 0.79 CCR3 (0.56) KCNA3CCR3CCR1
Hydrochloric Acid SCHEMBL11627731 0.78 CCR3 (0.62) KCNA3CCR3CCR1RAB9ANPSR1
SCHEMBL7461929 0.78 SIGMAR1 (0.57) KCNA3CCR3CCR1SIGMAR1

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