SCHEMBL8879656

SCHEMBL8879656

C#CC(C(=O)Oc1c(-c2ccc(F)cc2)cc(-c2ccccc2Cc2ccccc2)nc1C(C)C)(C(C)O)[PH](=O)O

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTGDR2 Q9Y5Y4 2/20 0.32
HMGCR P04035 2/20 0.31

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
SCHEMBL8877709 0.93 PTGDR2 (0.32) PTGDR2
SCHEMBL8877833 0.89 HMGCR (0.32) HMGCR
SCHEMBL8878790 0.88 HMGCR (0.38) KMT2AHMGCR
SCHEMBL8877175 0.86 PPARG (0.33)
SCHEMBL8878156 0.84 HMGCR (0.35) HMGCR
SCHEMBL8878140 0.84 CHEK1 (0.31)
SCHEMBL8878938 0.83 HMGCR (0.33) HMGCR
SCHEMBL8877239 0.83 HMGCR (0.31) HMGCR
SCHEMBL8879650 0.82 MEN1 (0.34) MEN1KMT2APTGDR2HMGCR
SCHEMBL8876647 0.82 HMGCR (0.37) HMGCR

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 2 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