SCHEMBL9028198

SCHEMBL9028198

C=C(C)Cc1c(O)cc(C)c(O)c1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.36
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36
BCL2L2 Q92843 1/20 0.36
LMNA P02545 2/20 0.33
LDHA P00338 1/20 0.32
LDHB P07195 1/20 0.32
AKR1B1 P15121 1/20 0.31
MAOB P27338 2/20 0.31
ALB P02768 1/20 0.31
HTT P42858 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
TRPA1 O75762 1/20 0.31
PTGS1 P23219 1/20 0.31
CACNA1C Q13936 1/20 0.31
APP P05067 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
SCHEMBL14283810 0.75 KDM4E (0.34) LMNAMAOBHTTKDM4EMEN1
SCHEMBL9029561 0.75 PTGS1 (0.43) LMNAHTTTRPA1PTGS1CACNA1C
SCHEMBL9027854 0.73 CA1 (0.38) LMNAHTTTRPA1PTGS1NPC1
SCHEMBL9028203 0.73 HTT (0.41) LMNALDHALDHBMAOBHTT
SCHEMBL9028594 0.71 LMNA (0.43) LMNAHTTTRPA1NPC1HPGD
SCHEMBL9028451 0.69 SELL (0.39) BCL2BCL2L1MCL1LMNAMAOB
SCHEMBL9028429 0.68 GABRA1 (0.35) AKR1B1KDM4EMEN1KMT2A
SCHEMBL9862023 0.68 BCL2 (0.50) BCL2BCL2L1MCL1BCL2L2LMNA
SCHEMBL9405316 0.66 CA1 (0.44) LMNAMAOBKDM4EMEN1MAPT
SCHEMBL658037 0.66 PGK1 (0.34) MAOBAPP

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