SCHEMBL9027682

SCHEMBL9027682

C=CCc1c2c(c(C(C)C)c(OC(C)=O)c1C(C)C)CC(C)(C)O2

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SRD5A1 P18405 1/20 0.33
PDE4A P27815 1/20 0.32
PDE3A Q14432 1/20 0.32
TP53 P04637 1/20 0.31
CYP3A4 P08684 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
SCHEMBL9028319 0.79
SCHEMBL9027689 0.77 KDM4E (0.36) MEN1KMT2AKDM4ESRD5A1
SCHEMBL9027770 0.76 MEN1 (0.33) MEN1KMT2AKDM4ESRD5A1PDE4A
SCHEMBL9028097 0.76 MAOB (0.36)
SCHEMBL9028180 0.75 MEN1 (0.33) MEN1KMT2AKDM4ESRD5A1PDE4A
SCHEMBL9028192 0.69 KDM4E (0.37) MEN1KMT2AKDM4ESRD5A1
SCHEMBL6766966 0.68 ALDH1A1 (0.33) KDM4ETP53CYP3A4
SCHEMBL9028221 0.67 FFAR4 (0.33)
SCHEMBL9571427 0.65 ALDH1A1 (0.31) MEN1KMT2A
SCHEMBL9571516 0.65 EZH2 (0.31)

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