SCHEMBL8617172

SCHEMBL8617172

C=C(C)COCCOC(=O)Cl

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.42
ALDH1A1 P00352 3/20 0.39
TSHR P16473 3/20 0.39
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
CES2 O00748 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
SCHEMBL7261367 0.83 THRB (0.45) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL5962150 0.83 ALDH1A1 (0.58) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL10594437 0.81 THRB (0.44) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL5606632 0.80
SCHEMBL28387026 0.79 THRB (0.42) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL29016951 0.79 THRB (0.42) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL1791414 0.79 ADRA2A (0.43) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL29173022 0.79 THRB (0.68) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL631462 0.79 HSD17B10 (0.37) THRBALDH1A1TSHRHSD17B10CES2
SCHEMBL1794656 0.78 TSHR (0.47) THRBALDH1A1TSHRTP53HIF1A

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 5 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 disclosed
US-5494988-A FREE RADICAL INITIATORS AS MONOMERS; CROSSLINKING UNSATURATED POLYESTERS; ADDITION, GRAFT AND BLOCK POLYMERIZATION; COMPATIBILIZING BLENDS ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-02-27 US disclosed
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
US-5475072-A Curing; crosslinking; modifiying; grafting; compatibilizing ELF ATOCHEM NORTH AMERICA, INC. (US) 1995-12-12 US disclosed
EP-0667339-A1 Novel unsaturated peroxides, polymeric derived therefrom and their uses ELF ATOCHEM NORTH AMERICA, INC. (US) 1995-08-16 EP disclosed