SCHEMBL9801635

SCHEMBL9801635

CCC1CN(CC(C)O)CCO1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 6/20 0.34
USP2 O75604 1/20 0.33
HRH3 Q9Y5N1 2/20 0.32
DRD4 P21917 6/20 0.32
PDK1 Q15118 2/20 0.32
ALDH1A1 P00352 1/20 0.31
DRD2 P14416 1/20 0.31
PIK3CD O00329 1/20 0.31
GRM2 Q14416 1/20 0.30

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
SCHEMBL9921758 0.86 PIK3CD (0.44) DRD3HRH3DRD4PDK1ALDH1A1
SCHEMBL9801377 0.83 HRH3 (0.32) DRD3HRH3DRD4PDK1PIK3CD
SCHEMBL24737031 0.81 DRD4 (0.36) DRD3HRH3DRD4PDK1
SCHEMBL9801239 0.79 PDK1 (0.43) USP2PDK1ALDH1A1
SCHEMBL13887674 0.77 HRH3 (0.46) DRD3HRH3DRD4PDK1DRD2
SCHEMBL9801701 0.77 HRH3 (0.46) DRD3HRH3DRD4PDK1DRD2
Hydrochloric Acid SCHEMBL6549658 0.76 ALDH1A1 (0.34) DRD3USP2ALDH1A1DRD2
Bromide SCHEMBL19439574 0.76 HRH3 (0.44) DRD3HRH3DRD4PDK1DRD2
SCHEMBL6064719 0.75 HRH3 (0.40) HRH3PDK1
SCHEMBL6064721 0.75 KDM4E (0.42) DRD3HRH3DRD4PDK1ALDH1A1

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