SCHEMBL6248142

SCHEMBL6248142

C=C(C)C(=O)OOCC(C)CC(C)O

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
ALDH1A1 P00352 1/20 0.34
THRB P10828 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
SCHEMBL7665484 0.81 TSHR (0.62) TSHRALDH1A1THRB
SCHEMBL6900127 0.81 TSHR (0.31) TSHR
Methacrylic Acid SCHEMBL23466855 0.80 TSHR (0.46) TSHRALDH1A1THRB
SCHEMBL9063791 0.79 TSHR (0.63) TSHRALDH1A1THRB
SCHEMBL3873065 0.76 TSHR (0.48) TSHRALDH1A1THRB
SCHEMBL6249219 0.76 MAPT (0.31)
SCHEMBL2927266 0.74 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL28975548 0.73 MAPK1 (0.36) TSHRALDH1A1
SCHEMBL473649 0.73 TSHR (0.55) TSHRALDH1A1THRB
Hydrochloric Acid SCHEMBL4626985 0.71 MAPT (0.41) TSHRALDH1A1THRB

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-1564225-B1 Non-gel hydroxyperoxyester emulsion ARKEMA FRANCE (FR) 2014-11-12 EP claimed
EP-1564225-B1 Non-gel hydroxyperoxyester emulsion ARKEMA FRANCE (FR) 2014-11-12 EP disclosed
EP-1564225-A1 Non-gel hydroxyperoxyester emulsion ARKEMA (FR) 2005-08-17 EP disclosed