SCHEMBL8877852

SCHEMBL8877852

CC(C)c1nc(-c2cccc3ccccc23)cc(-c2ccc(F)cc2)c1CO

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCGR P47871 14/20 0.49
HMGCR P04035 1/20 0.44

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
SCHEMBL8877443 0.85 GCGR (0.54) GCGRHMGCR
SCHEMBL8877568 0.84 HMGCR (0.58) GCGRHMGCR
SCHEMBL8876808 0.81 MEN1 (0.46) HMGCR
SCHEMBL8877432 0.81 HMGCR (0.44) GCGRHMGCR
SCHEMBL8878690 0.81 GCGR (0.46) GCGRHMGCR
SCHEMBL8876862 0.81 HMGCR (0.42) GCGRHMGCR
SCHEMBL6963687 0.79 GCGR (0.62) GCGRHMGCR
SCHEMBL8877810 0.78 GCGR (0.44) GCGRHMGCR
SCHEMBL2663566 0.77 GCGR (0.58) GCGR
SCHEMBL8878033 0.77 GCGR (0.55) GCGR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691322-A Quinoline and pyridine anchors for HMG-CoA reductase inhibitors E.R. SQUIBB & SONS, INC. (US) 1997-11-25 US disclosed
US-5686433-A CHOLESTEROL BIOSYNTHESIS INHIBITION E.R. SQUIBB & SONS, INC. (US) 1997-11-11 US disclosed
US-5506219-A ANTICHOLESTEROL AND ANTILIPEMIC AGENTS E. R. SQUIBB & SONS, INC. (US) 1996-04-09 US disclosed