SCHEMBL9027584

SCHEMBL9027584

C=CCc1c(O)cccc1CCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.46
GABRA1 P14867 2/20 0.44
GABRB2 P47870 2/20 0.44
AKR1B1 P15121 1/20 0.39
IAPP P10997 3/20 0.38
HTR1A P08908 1/20 0.38
ELANE P08246 1/20 0.37
CTSG P08311 1/20 0.37
BID P55957 3/20 0.36
MCL1 Q07820 3/20 0.36
BCL2L1 Q07817 2/20 0.36
BAK1 Q16611 2/20 0.36
KAT8 Q9H7Z6 2/20 0.36
SRD5A1 P18405 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
EP300 Q09472 1/20 0.36
KAT2A Q92830 1/20 0.36
KAT2B Q92831 1/20 0.36
KAT5 Q92993 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
SCHEMBL11814659 0.90 BID (0.44) MTNR1AGABRA1GABRB2IAPPELANE
SCHEMBL84570 0.89 BID (0.50) MTNR1ABIDMCL1BCL2L1BAK1
Propylene Oxide SCHEMBL29248582 0.89 MTNR1A (0.40) MTNR1AGABRA1GABRB2AKR1B1IAPP
SCHEMBL8518967 0.87 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL8583416 0.87 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
Hydrogen Sulfide SCHEMBL5261196 0.87 BID (0.49) MTNR1ABIDMCL1BCL2L1BAK1
SCHEMBL12802066 0.87 GABRA1 (0.42) MTNR1AGABRA1GABRB2AKR1B1MEN1
SCHEMBL28738149 0.86 MTNR1A (0.48) MTNR1AGABRA1GABRB2AKR1B1IAPP
SCHEMBL254084 0.83 GABRA1 (0.57) MTNR1AGABRA1GABRB2AKR1B1SRD5A1
SCHEMBL27372200 0.83 IAPP (0.41) MTNR1AGABRA1GABRB2IAPPHTR1A

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