SCHEMBL9801557

SCHEMBL9801557

CC(O)CN1CCN(CCN)C(C)(C)C1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 1/20 0.34
ALOX15 P16050 1/20 0.33
SLC6A3 Q01959 2/20 0.32
DRD2 P14416 3/20 0.31
DRD3 P35462 3/20 0.31
DRD4 P21917 1/20 0.31
SLC29A1 Q99808 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
SCHEMBL9801197 0.91 SLC29A1 (0.34) KCNJ1SLC6A3SLC29A1
SCHEMBL9801509 0.85 ALOX15 (0.34) KCNJ1ALOX15
SCHEMBL9801101 0.85 KCNJ1 (0.34) KCNJ1SLC6A3DRD2DRD3DRD4
SCHEMBL9801475 0.85 KCNJ1 (0.34) KCNJ1SLC6A3DRD2DRD3DRD4
SCHEMBL9801110 0.84 KCNJ1 (0.40) KCNJ1SLC6A3DRD2DRD3DRD4
SCHEMBL9801147 0.82 KCNJ1 (0.37) KCNJ1DRD2DRD3
SCHEMBL9801481 0.81 KCNJ1 (0.36) KCNJ1SLC6A3DRD2DRD3DRD4
SCHEMBL9801620 0.81 ALOX15 (0.48) ALOX15SLC29A1
SCHEMBL9801415 0.78 ALOX15 (0.37) ALOX15SLC29A1
SCHEMBL9801605 0.78 SLC6A3 (0.35) SLC6A3DRD2DRD3DRD4

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