SCHEMBL7961497

SCHEMBL7961497

FC(F)(F)c1ccc(O[C@H]2CCN(c3ccncc3)C2)nc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.60
LIPE Q05469 8/20 0.47
HSD11B1 P28845 3/20 0.46
HRH3 Q9Y5N1 1/20 0.44
SCD O00767 1/20 0.43
SCN3A Q9NY46 1/20 0.42
NOTUM Q6P988 1/20 0.41
CYP3A4 P08684 3/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 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
SCHEMBL7956252 1.00 LIPG (0.60) LIPGLIPEHSD11B1HRH3SCD
SCHEMBL7956524 1.00 LIPG (0.60) LIPGLIPEHSD11B1HRH3SCD
SCHEMBL7961541 0.93 LIPG (0.53) LIPGLIPEHSD11B1HRH3CYP3A4
SCHEMBL7961398 0.85 LIPG (0.57) LIPGLIPEHSD11B1HRH3SCD
SCHEMBL29935534 0.85 LIPG (0.59) LIPGLIPEHSD11B1HRH3NOTUM
SCHEMBL29935625 0.85 LIPG (0.57) LIPGLIPEHSD11B1HRH3SCN3A
SCHEMBL7947575 0.85 LIPG (0.57) LIPGLIPEHSD11B1HRH3SCD
Ammonia Solution, Strong SCHEMBL23703282 0.84 LIPG (0.58) LIPGLIPEHSD11B1HRH3NOTUM
SCHEMBL7947501 0.84 LIPG (0.61) LIPGLIPEHSD11B1HRH3SCD
SCHEMBL7958655 0.84 LIPG (0.50) LIPGSCDNOTUMCYP3A4

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