SCHEMBL9028093

SCHEMBL9028093

C=CCc1c2c(cc(OCc3ccccc3)c1C(C)(C)C)CC(C)(C)O2

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.38
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALOX5AP P20292 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
KMT2A Q03164 1/20 0.33
CHRNA7 P36544 2/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.31
HIF1A Q16665 1/20 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
SCHEMBL9028672 0.85 NPC1 (0.38) MAOBNPC1RAB9AALOX5APL3MBTL1
SCHEMBL9028059 0.84 NPC1 (0.39) MAOBNPC1RAB9AL3MBTL1KMT2A
SCHEMBL9028068 0.83 MAOB (0.38) MAOBNPC1RAB9AL3MBTL1KMT2A
SCHEMBL9028070 0.83 NPC1 (0.38) MAOBNPC1RAB9AL3MBTL1KMT2A
SCHEMBL9028073 0.79 MAOB (0.35) MAOBNPC1RAB9AL3MBTL1MAPT
SCHEMBL9028599 0.76 MAOB (0.35) MAOBL3MBTL1MAPTMAPK1TDP1
SCHEMBL9028360 0.75 HMGCR (0.37)
SCHEMBL9028612 0.75 HTR2A (0.34)
SCHEMBL30110206 0.72 MAOB (0.44) MAOBNPC1RAB9AL3MBTL1KMT2A
SCHEMBL9028160 0.71 NPC1 (0.39) MAOBNPC1RAB9AL3MBTL1KMT2A

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