SCHEMBL9028097

SCHEMBL9028097

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

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.36
GLRA1 P23415 2/20 0.32
BCHE P06276 3/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 2/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30

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
SCHEMBL9028660 0.85 MAOB (0.36) MAOBGLRA1BCHEALDH1A1HPGD
SCHEMBL9029047 0.83 LTA4H (0.38) MAOBGLRA1BCHEALDH1A1HPGD
SCHEMBL9029180 0.81 MAOB (0.38) MAOBBCHEALDH1A1HPGDGAA
SCHEMBL9028068 0.80 MAOB (0.38) MAOBMAPTTDP1L3MBTL1NPC1
SCHEMBL9028797 0.79 MAOB (0.35) MAOBGLRA1ALDH1A1HPGDGAA
SCHEMBL9028108 0.79 MAOB (0.36) MAOBBCHEALDH1A1HPGDGAA
SCHEMBL9029436 0.79 MAOB (0.32) MAOB
SCHEMBL9029450 0.79 MAOB (0.32) MAOB
SCHEMBL9028968 0.78 MAOB (0.37) MAOBGLRA1ALDH1A1HPGDGAA
SCHEMBL9028395 0.78 MAOB (0.38) MAOBGLRA1ALDH1A1GAAMAPT

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