SCHEMBL9028205

SCHEMBL9028205

C=CCc1c(C)cc(C)c(CC(=C)C)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.38
APP P05067 1/20 0.37
GAA P10253 3/20 0.37
KDM4E B2RXH2 2/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 2/20 0.32
XDH P47989 1/20 0.31
ALOX5 P09917 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
OPRM1 P35372 1/20 0.30
GABRA1 P14867 3/20 0.30
GABRB2 P47870 3/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ALDH2 P05091 1/20 0.30
MAPT P10636 1/20 0.30
AKR1B1 P15121 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL9571652 0.85 MAOB (0.33) MAOBAPPGAAKDM4EGLA
SCHEMBL9571334 0.85 MAOB (0.35) MAOBAPPGAAKDM4EGLA
SCHEMBL9028012 0.79 MAOB (0.34) MAOBGAAKDM4EGLAHPGD
SCHEMBL21002168 0.78 GAA (0.40) MAOBAPPGAAKDM4EGLA
SCHEMBL658037 0.78 PGK1 (0.34) MAOBAPPALDH1A1
SCHEMBL660212 0.78 GAA (0.40) MAOBAPPGAAKDM4EGLA
SCHEMBL658062 0.75 GAA (0.38) MAOBAPPGAAKDM4EGLA
SCHEMBL660261 0.75 MAOB (0.30) MAOB
SCHEMBL2649487 0.75 KDM4E (0.39) MAOBAPPGAAKDM4EGLA
SCHEMBL660484 0.74 ALDH1A1 (0.37) KDM4EALDH1A1

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 5 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-5266707-A Anticholesterol FUJIREBIO INC. (JP) 1993-11-30 US disclosed
EP-0539709-A1 3,5-Dihydroxyheptanoic acid derivatives and lactones thereof as HMG-CoA reductase inhibitors FUJIREBIO Inc. (JP) 1993-05-05 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