SCHEMBL8616134

SCHEMBL8616134

CC(CC(C)(C)OOC(C)(C)C)C(C(=O)O)=C(C(=O)O)C(C)CC(C)(C)OOC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL8616131 1.00 TSHR (0.32) TSHRTDP1
SCHEMBL28633964 0.86 ALDH1A1 (0.30) TSHRTDP1
SCHEMBL8613779 0.83
SCHEMBL10440875 0.77
SCHEMBL7755958 0.76
SCHEMBL8462329 0.74 TSHR (0.31) TSHRTDP1
Bicarbonate SCHEMBL11516562 0.74 TSHR (0.31) TSHRTDP1
SCHEMBL7627246 0.73
SCHEMBL8619065 0.73
SCHEMBL8619062 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0667339-B1 Novel unsaturated peroxides, polymeric peroxides derived therefrom and their uses ATOCHEM NORTH AMERICA ELF (US) 1998-05-06 EP claimed
US-5489699-A USED AS FREE RADICAL GENERATOR, POLYMERIZING ETHYNICALLY UNSATURATED MONOMERS, CURING AGENT, RHEOLOGICAL MODIFIER,AND FOR GRAFTING AND COMPATIBILIZING POLYMER BLEND ELFATOCHEM NORTH AMERICA, INC. (US) 1996-02-06 US disclosed