SCHEMBL8876019

SCHEMBL8876019

CC(C)c1nc(-c2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)c1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.51
FABP4 P15090 1/20 0.51
FABP5 Q01469 1/20 0.51
GCGR P47871 1/20 0.46
DHODH Q02127 6/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL8879687 0.91 FABP3 (0.50) FABP3FABP4FABP5GCGRDHODH
SCHEMBL8880484 0.90 DHODH (0.53) FABP3FABP4FABP5GCGRDHODH
SCHEMBL8879109 0.90 FABP3 (0.49) FABP3FABP4FABP5GCGRDHODH
SCHEMBL8879628 0.88 DHODH (0.55) FABP3FABP4FABP5GCGRDHODH
SCHEMBL2651071 0.84 GCGR (0.56) FABP3FABP4FABP5GCGR
SCHEMBL10433875 0.82 HMGCR (0.48) FABP3FABP4FABP5GCGRDHODH
SCHEMBL8875946 0.82 FABP3 (0.60) FABP3FABP4FABP5GCGRDHODH
SCHEMBL5098308 0.81 GCGR (0.50) FABP3FABP4FABP5GCGR
SCHEMBL27293870 0.80 GCGR (0.49) FABP3FABP4FABP5GCGR
SCHEMBL8878602 0.79 GCGR (0.64) 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