SCHEMBL9265994

SCHEMBL9265994

C[SiH](C)OC(C1CC=CC(=O)O1)C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 3/20 0.31
MEN1 O00255 1/20 0.30
JAK2 O60674 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 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
SCHEMBL6338489 0.74
SCHEMBL6334901 0.74
SCHEMBL15946714 0.70 MEN1 (0.38) CCR5MEN1JAK2LMNAMAPT
SCHEMBL12202938 0.70 MEN1 (0.38) CCR5MEN1JAK2LMNAMAPT
SCHEMBL6411507 0.68
SCHEMBL6411494 0.68
SCHEMBL9004300 0.67 MEN1 (0.38) MEN1JAK2LMNAMAPTHTT
SCHEMBL17028437 0.67 MEN1 (0.38) MEN1JAK2LMNAMAPTHTT
SCHEMBL13461064 0.67 MEN1 (0.38) MEN1JAK2LMNAMAPTHTT
SCHEMBL5552553 0.66

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
US-5443970-A SEPARATION OF ISOMERS IN A MIXTURE BY SELECTIVE REACTION ZENECA LIMITED (GB) 1995-08-22 US 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