SCHEMBL9849121

SCHEMBL9849121

Cc1c2c(c(C(C)[C@@H]3C[C@@H](O)CC(=O)O3)c(C(C)(C)C)c1OCc1ccccc1)OC(C)(C)C2

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.32
CASP1 P29466 4/20 0.32
CASP3 P42574 4/20 0.32
CASP7 P55210 4/20 0.32
CASP6 P55212 4/20 0.32
CASP8 Q14790 4/20 0.32
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
IDO1 P14902 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
SCHEMBL9849056 0.94 MAOB (0.32) MAOBCASP1CASP3CASP7CASP6
SCHEMBL9780082 0.91 MAOB (0.34) MAOBCASP1CASP3CASP7CASP6
SCHEMBL9026625 0.83
SCHEMBL9849073 0.83 CASP1 (0.37) MAOBCASP1CASP3CASP7CASP6
SCHEMBL9026617 0.83
SCHEMBL9027154 0.78
SCHEMBL9027167 0.78
SCHEMBL9571397 0.78 NR3C1 (0.34)
SCHEMBL9571399 0.78 TSHR (0.34) IDO1
SCHEMBL9849041 0.77

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0445827-A2 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO INC. (JP) 1991-09-11 EP claimed
EP-0445827-A2 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO INC. (JP) 1991-09-11 EP disclosed