SCHEMBL9029019

SCHEMBL9029019

C=CCc1c(O)cc(C)c(O)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.39
KDM4E B2RXH2 3/20 0.39
GLA P06280 1/20 0.39
ALOX5 P09917 2/20 0.38
PTGS1 P23219 2/20 0.38
PTGS2 P35354 1/20 0.38
XDH P47989 1/20 0.37
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH2 P05091 1/20 0.36
AKR1B1 P15121 1/20 0.36
HPGD P15428 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36

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
SCHEMBL11219745 0.85 GAA (0.39) GAAKDM4EGLAALOX5PTGS1
SCHEMBL10399372 0.81 GAA (0.46) GAAKDM4EGLAALOX5PTGS1
SCHEMBL28027382 0.81 KDM4E (0.38) GAAKDM4EGLAALOX5PTGS1
SCHEMBL14283811 0.79 CYP19A1 (0.51) GAAALOX5PTGS1PTGS2MEN1
SCHEMBL14072697 0.75 XDH (0.42) GAAKDM4EGLAALOX5PTGS1
SCHEMBL29115719 0.75 PTPN1 (0.47) GAAKDM4EGLAALOX5PTGS1
SCHEMBL14283816 0.75 SHBG (0.45) GAAKDM4EALDH1A1MEN1MAPT
SCHEMBL11613964 0.75 ESR1 (0.40) GAAKDM4EALOX5PTGS1PTGS2
SCHEMBL22139408 0.74 XDH (0.45) GAAKDM4EGLAALOX5PTGS1
SCHEMBL6591933 0.74 SRD5A1 (0.47) GAAKDM4EGLAALOX5PTGS1

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