SCHEMBL9027463

SCHEMBL9027463

CCCc1c(OCc2ccccc2)cc2c(c1CCC(O)CC(=O)CC(=O)OCC)OC(C)(C)C2

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TSHR P16473 2/20 0.34
KMT2A Q03164 3/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
POLB P06746 1/20 0.33
HBB P68871 1/20 0.33
MEN1 O00255 1/20 0.33
MMP12 P39900 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL9027455 0.90 NPC1 (0.37) HMGCRNPC1RAB9ATSHRKMT2A
SCHEMBL9027431 0.89 NPC1 (0.36) HMGCRNPC1RAB9ATSHRKMT2A
SCHEMBL9029044 0.85 MMP12 (0.33) HMGCRNPC1RAB9APPARGPPARD
SCHEMBL9028889 0.84 MMP12 (0.33) HMGCRNPC1RAB9APPARGPPARD
SCHEMBL9028088 0.80 MMP12 (0.34) HMGCRNPC1RAB9APPARGPPARD
SCHEMBL9029053 0.79 NPC1 (0.39) NPC1RAB9ATSHRKMT2AMEN1
SCHEMBL9029035 0.78 MMP12 (0.33) HMGCRNPC1RAB9APPARGPPARD
SCHEMBL9028495 0.78 MMP12 (0.32) HMGCRNPC1RAB9ATSHRPPARG
SCHEMBL9028883 0.78 MMP12 (0.32) HMGCRNPC1RAB9APPARGPPARD
SCHEMBL9027939 0.77 HMGCR (0.32) HMGCRNPC1RAB9AMMP12

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
EP-0445827-B1 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO KK (JP) 1996-09-25 EP disclosed
US-5149834-A Anticholesterol agent and enzyme inhibitors, for curing arteriosclerosis FUJIREBIO INC. (JP) 1992-09-22 US disclosed
EP-0445827-A2 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO INC. (JP) 1991-09-11 EP disclosed