SCHEMBL4595118

SCHEMBL4595118

CC(C)(C)[Si](C)(C)OC1CC(=O)OC(CI)C1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.36
HDAC1 Q13547 3/20 0.36
HDAC2 Q92769 3/20 0.36
HDAC6 Q9UBN7 3/20 0.36
BUB1 O43683 1/20 0.32
TOP2A P11388 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
SCHEMBL2169371 1.00 HMGCR (0.36) HMGCRHDAC1HDAC2HDAC6BUB1
SCHEMBL2167968 1.00 HMGCR (0.36) HMGCRHDAC1HDAC2HDAC6BUB1
SCHEMBL10024055 0.87 HMGCR (0.37) HMGCRHDAC1HDAC2HDAC6BUB1
SCHEMBL2168815 0.85 HMGCR (0.36) HMGCRHDAC1HDAC2HDAC6TOP2A
SCHEMBL9269812 0.85 HMGCR (0.38) HMGCRHDAC1HDAC2HDAC6TOP2A
SCHEMBL4643619 0.85 HMGCR (0.38) HMGCRHDAC1HDAC2HDAC6TOP2A
SCHEMBL2067039 0.85 HMGCR (0.38) HMGCRHDAC1HDAC2HDAC6TOP2A
SCHEMBL10024054 0.85 HMGCR (0.38) HMGCRHDAC1HDAC2HDAC6TOP2A
SCHEMBL10024025 0.85 HMGCR (0.38) HMGCRHDAC1HDAC2HDAC6TOP2A
SCHEMBL4440967 0.85 HMGCR (0.38) HMGCRHDAC1HDAC2HDAC6TOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0604483-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY PURE 4-HYDROXYTETRAHYDRO-2-PYRANONE DERIVATIVES ZENECA LIMITED (GB) 1994-07-06 EP claimed
WO-1993006235-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY PURE 4-HYDROXYTETRAHYDRO-2-PYRANONE DERIVATIVES ZENECA LIMITED (GB) 1993-04-01 WO claimed
EP-1937696-A1 PROCESS FOR THE SYNTHESIS OF HMG-CoA REDUCTASE INHIBITORS LEK Pharmaceuticals D.D. (SI) 2008-07-02 EP disclosed
WO-2007039287-A1 PROCESS FOR THE SYNTHESIS OF HMG-CoA REDUCTASE INHIBITORS LEK PHARMACEUTICALS D.D. (SI) 2007-04-12 WO disclosed
EP-0604483-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY PURE 4-HYDROXYTETRAHYDRO-2-PYRANONE DERIVATIVES ZENECA LIMITED (GB) 1994-07-06 EP disclosed
WO-1993006235-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY PURE 4-HYDROXYTETRAHYDRO-2-PYRANONE DERIVATIVES ZENECA LIMITED (GB) 1993-04-01 WO disclosed