SCHEMBL7720760

SCHEMBL7720760

CC(C)(C)OC(=O)CC1C[C@@H](CO)OC(C)(C)O1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.34
NR1H2 P55055 1/20 0.34
HCRTR2 O43614 1/20 0.31
EPHX2 P34913 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
SCHEMBL9453175 1.00 MIF (0.34) MIFNR1H2HCRTR2EPHX2
SCHEMBL5728730 1.00 MIF (0.34) MIFNR1H2HCRTR2EPHX2
SCHEMBL247199 1.00 MIF (0.34) MIFNR1H2HCRTR2EPHX2
Alcohol SCHEMBL6702863 0.97 MIF (0.33) MIFNR1H2
SCHEMBL31070837 0.88 MIF (0.33) MIFNR1H2
SCHEMBL15887309 0.88 MIF (0.33) MIFNR1H2
SCHEMBL4015355 0.88 MIF (0.33) MIFNR1H2
SCHEMBL22043547 0.88 CYP1A2 (0.39) MIFHCRTR2EPHX2
SCHEMBL6125270 0.88 MIF (0.34) MIFHCRTR2EPHX2
SCHEMBL4188806 0.87 MIF (0.34) MIFHCRTR2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3141544-A1 PREPARATION METHOD FOR CHIRAL INTERMEDIATE FOR USE IN STATINS Asymchem Laboratories (Tianjin) Co., Ltd (CN) 2017-03-15 EP disclosed
EP-2665722-A1 PROCESS FOR THE PREPARATION OF DIOL SULFONES DSM Sinochem Pharmaceuticals Netherlands B.V. (NL) 2013-11-27 EP disclosed
WO-2012098048-A1 PROCESS FOR THE PREPARATION OF DIOL SULFONES DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) 2012-07-26 WO disclosed
WO-2011121595-A1 A PROCESS FOR THE PREPARATION OF ROSUVASTATIN CALCIUM NEULAND LABORATORIES LTD. (IN) 2011-10-06 WO disclosed