SCHEMBL6910648

SCHEMBL6910648

CCCNC1CCC(C)=C(C)C1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 12/20 0.47
DRD2 P14416 12/20 0.47
DRD4 P21917 5/20 0.47
HTR1B P28222 3/20 0.47
HTR1D P28221 3/20 0.47
HRH2 P25021 2/20 0.46
ADRA2A P08913 2/20 0.46
ADRB2 P07550 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
HTR2A P28223 1/20 0.46
HTR7 P34969 1/20 0.46
ADRA1A P35348 1/20 0.46
HRH1 P35367 1/20 0.46
HTR2B P41595 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
HRH4 Q9H3N8 1/20 0.46

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
SCHEMBL10885801 0.89 DRD3 (0.49) DRD3DRD2DRD4HTR1BHTR1D
SCHEMBL6903938 0.85 DRD2 (0.39) DRD3DRD2DRD4HTR1BHTR1D
SCHEMBL6910912 0.83 DRD3 (0.41) DRD3DRD2DRD4HTR1BHTR1D
SCHEMBL22995725 0.79 DRD3 (0.41) DRD3DRD2DRD4HTR1BHTR1D
SCHEMBL5864289 0.72 DRD2 (0.37) DRD3DRD2DRD4
SCHEMBL939870 0.71 DRD3 (0.42) DRD3DRD2DRD4HTR1BHTR1D
SCHEMBL2598589 0.71 GRIN2B (0.67) DRD3DRD2DRD4HTR1BHTR1D
SCHEMBL2597220 0.71 GRIN2B (0.67) DRD3DRD2DRD4HTR1BHTR1D
SCHEMBL8393323 0.71 GRIN2B (0.67) DRD3DRD2DRD4HTR1BHTR1D
SCHEMBL31208094 0.71 GRIN2B (0.67) DRD3DRD2DRD4HTR1BHTR1D

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-1066337-B1 OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS CHEVRON PHILLIPS CHEMICAL CO (US) 2004-11-03 EP claimed