SCHEMBL7056542

SCHEMBL7056542

CCCC(C)(C)OOC(=O)OCC(C)(COC(=O)OOC(C)(C)CCC)COC(=O)OOC(C)(C)CCC

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
HSD17B10 Q99714 1/20 0.47
TSHR P16473 2/20 0.36
CYP3A4 P08684 1/20 0.36
NFKB1 P19838 1/20 0.36
ADRA1A P35348 1/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL7058426 0.98 LMNA (0.46) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL11517356 0.88 LMNA (0.40) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL7060332 0.87 LMNA (0.38) LMNAHSD17B10
SCHEMBL7060351 0.86 LMNA (0.37) LMNAHSD17B10
SCHEMBL6862239 0.85 LMNA (0.37) LMNAHSD17B10TSHRTDP1
SCHEMBL7052751 0.84 LMNA (0.36) LMNAHSD17B10
SCHEMBL6929790 0.80 ALDH1A1 (0.34) LMNAHSD17B10TSHR
SCHEMBL7059827 0.80 ATM (0.46) LMNAHSD17B10TSHRRAB9ATDP1
SCHEMBL11517359 0.79 LMNA (0.32) LMNAHSD17B10
SCHEMBL8387306 0.79 NAAA (0.43) LMNATSHRCYP3A4

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-0908450-B1 Novel polyfunctional peroxides, vinyl monomer polymerization initiators comprising the same and process for polymerizing vinyl monomers employing the same NOF CORP (JP) 2003-05-07 EP disclosed
US-5973181-A BIS(2,2-BIS(TERT-ALKYLPEROXYCARBONYLOXYMETHYL)ALKYL CARBONATE NOF CORPORATION (JP) 1999-10-26 US disclosed
EP-0908450-A2 Novel polyfunctional peroxides, vinyl monomer polymerization initiators comprising the same and process for polymerizing vinyl monomers employing the same NOF CORPORATION (JP) 1999-04-14 EP disclosed