SCHEMBL8423920

SCHEMBL8423920

CC(C)(OOC(C)(C)C1CCCCC1)OC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 10/20 0.32
CHRM2 P08172 5/20 0.32
CHRM4 P08173 5/20 0.32
CHRM1 P11229 5/20 0.32
EPHX1 P07099 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
SSTR4 P31391 1/20 0.31
HPGD P15428 1/20 0.31
GAA P10253 1/20 0.30
RIPK1 Q13546 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
SCHEMBL8423916 0.87 EPHX1 (0.33) CHRM3CHRM2CHRM4CHRM1EPHX1
SCHEMBL27559873 0.87 EPHX1 (0.36) CHRM3CHRM2CHRM4CHRM1EPHX1
SCHEMBL8426633 0.80 TSHR (0.33) CHRM3CHRM2CHRM4CHRM1EPHX1
SCHEMBL11042839 0.78 EPHX1 (0.30) EPHX1
SCHEMBL8427619 0.76 EPHX1 (0.33) CHRM3CHRM2CHRM4CHRM1EPHX1
SCHEMBL2311514 0.76 ALDH1A1 (0.35)
SCHEMBL19206706 0.75 EPHX1 (0.32) EPHX1SSTR4GAA
SCHEMBL12812730 0.75 EPHX1 (0.36) CHRM3CHRM2CHRM4CHRM1EPHX1
SCHEMBL1226214 0.75 EPHX1 (0.36) CHRM3CHRM2CHRM4CHRM1EPHX1
SCHEMBL29053766 0.75 HPGD (0.32) EPHX1HPGDGAA

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-0610016-B2 1-Cyclohexyl-1-methylethylperoxy carbonates, method for production thereof, and uses therefor NOF CORP (JP) 1999-10-20 EP disclosed
US-5446191-A Polymerization initiator for vinyl monomer, curing agent for unsaturated polyester NOF CORPORATION (JP) 1995-08-29 US disclosed
EP-0610016-A1 1-Cyclohexyl-1-methylethylperoxy carbonates, method for production thereof, and uses therefor NOF CORPORATION (JP) 1994-08-10 EP disclosed