SCHEMBL7954969

SCHEMBL7954969

Cc1cc(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)cc(C)n1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.53
LIPE Q05469 8/20 0.52
SCD O00767 2/20 0.46
MCHR1 Q99705 1/20 0.43
HCRTR1 O43613 4/20 0.43
RET P07949 1/20 0.42
HRH3 Q9Y5N1 2/20 0.41
ENPP2 Q13822 1/20 0.41

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
SCHEMBL7956670 0.89 LIPG (0.52) LIPGLIPESCDMCHR1HCRTR1
SCHEMBL7961398 0.82 LIPG (0.57) LIPGLIPESCDMCHR1HCRTR1
SCHEMBL7961541 0.82 LIPG (0.53) LIPGLIPEHRH3
SCHEMBL13279901 0.81 LIPG (0.55) LIPGLIPEMCHR1HRH3
SCHEMBL7956574 0.78 LIPG (0.57) LIPGLIPESCDRETHRH3
SCHEMBL20147461 0.78 LIPE (0.57) LIPGLIPEHRH3
SCHEMBL20070180 0.77 LIPE (0.57) LIPGLIPE
SCHEMBL20070188 0.77 LIPE (0.56) LIPGLIPEMCHR1HRH3ENPP2
SCHEMBL20145199 0.76 LIPE (0.55) LIPGLIPEHCRTR1
SCHEMBL7956524 0.75 LIPG (0.60) LIPGLIPESCDHRH3

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-6313127-B1 FOR THERAPY OF HYPERCHOLESTEROLEMIA OR ATHEROSCLEROSIS ZENECA LIMITED (GB) 2001-11-06 US disclosed