SCHEMBL9801730

SCHEMBL9801730

CCC1CN(CCCN)CCO1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
DRD3 P35462 7/20 0.37
GRM2 Q14416 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
DRD4 P21917 2/20 0.32

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
SCHEMBL12075474 0.95 KEAP1 (0.43) KEAP1SMN1; SMN2DRD3GRM2HRH3
SCHEMBL13229805 0.90 KEAP1 (0.42) KEAP1SMN1; SMN2DRD4
SCHEMBL9801751 0.89 DRD3 (0.39) KEAP1SMN1; SMN2DRD3GRM2HRH3
SCHEMBL24951149 0.89 DRD3 (0.39) KEAP1SMN1; SMN2DRD3GRM2HRH3
SCHEMBL11576109 0.86 DRD3 (0.42) DRD3HRH3DRD4
SCHEMBL10815638 0.84 EBP (0.44) DRD3DRD4
SCHEMBL9801025 0.83 DRD3 (0.40) DRD3GRM2DRD4
SCHEMBL12730048 0.83 HRH3 (0.37) DRD3HRH3DRD4
SCHEMBL22463761 0.83 EBP (0.47) DRD3DRD4
SCHEMBL5659819 0.83 EBP (0.47) DRD3DRD4

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
US-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed