SCHEMBL5956866

SCHEMBL5956866

C=CCCCCCCC.CCCCCCCCS(=O)(=O)O

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
EPHX2 P34913 2/20 0.57
ALDH1A1 P00352 1/20 0.48
FAAH O00519 3/20 0.42
PPARA Q07869 2/20 0.40

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
SCHEMBL5956953 1.00 TSHR (0.61) TSHREPHX2ALDH1A1FAAHPPARA
SCHEMBL3690296 0.90 MAPT (0.46) TSHREPHX2ALDH1A1
SCHEMBL3693008 0.90 MAPT (0.46) TSHREPHX2ALDH1A1
SCHEMBL1118367 0.90 MAPT (0.46) TSHREPHX2ALDH1A1
SCHEMBL3694314 0.90 MAPT (0.46) TSHREPHX2ALDH1A1
SCHEMBL23630404 0.90 MAPT (0.46) TSHREPHX2ALDH1A1
SCHEMBL8784927 0.90 MAPT (0.46) TSHREPHX2ALDH1A1
SCHEMBL93616 0.90 MAPT (0.46) TSHREPHX2ALDH1A1
SCHEMBL8218999 0.90 MAPT (0.46) TSHREPHX2ALDH1A1
SCHEMBL3700017 0.90 MAPT (0.46) TSHREPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608705-B1 SETTING COMPOSITION FOR A BATTERY ELECTROLYTE RHODIA CHIMIE SA (FR) 2006-12-06 EP claimed