SCHEMBL9801025

SCHEMBL9801025

CCC1CN(CCCO)CCO1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 9/20 0.40
PDK1 Q15118 1/20 0.33
CACNA1H O95180 1/20 0.33
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
DRD5 P21918 1/20 0.33
GBA1 P04062 1/20 0.33
EPHA2 P29317 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GRM2 Q14416 1/20 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
SCHEMBL6064721 0.89 KDM4E (0.42) DRD3PDK1CACNA1HDRD4EPHA2
SCHEMBL11576109 0.86 DRD3 (0.42) DRD3HTR1ADRD2DRD1DRD4
SCHEMBL3428332 0.86 PDK1 (0.46) DRD3PDK1DRD2DRD4GBA1
SCHEMBL3424587 0.86 PDK1 (0.46) DRD3PDK1DRD2DRD4GBA1
SCHEMBL10815638 0.84 EBP (0.44) DRD3HTR1ADRD2DRD1DRD4
SCHEMBL9801730 0.83 KEAP1 (0.48) DRD3DRD4GRM2
SCHEMBL12730048 0.83 HRH3 (0.37) DRD3CACNA1HDRD4
SCHEMBL22463761 0.83 EBP (0.47) DRD3HTR1ADRD2DRD1DRD4
SCHEMBL5659819 0.83 EBP (0.47) DRD3HTR1ADRD2DRD1DRD4
SCHEMBL25565642 0.82 DRD3 (0.51) DRD3DRD2DRD4

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