SCHEMBL16865162

SCHEMBL16865162

CC1CC1(C(=O)OCCOC(=O)C1(S(C)(=O)=O)CC1C)S(C)(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 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
SCHEMBL16865159 0.80 NPSR1 (0.39) NPSR1
SCHEMBL16865201 0.67 MAPT (0.35) NPSR1
SCHEMBL5789744 0.65 TSHR (0.35) NPSR1
SCHEMBL16865154 0.65 ALDH1A1 (0.32) NPSR1
SCHEMBL16865147 0.63 NAAA (0.35) NPSR1
SCHEMBL16865177 0.62 GAA (0.36) NPSR1
SCHEMBL5788644 0.61 BCHE (0.32) NPSR1
SCHEMBL5789967 0.61 BCHE (0.37) NPSR1
SCHEMBL16865188 0.59 CYP3A4 (0.47) NPSR1
SCHEMBL16865199 0.59 NPSR1 (0.30) NPSR1

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
US-20150188193-A1 NON-AQUEOUS LIQUID ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY FUJIFILM CORPORATION (JP) 2015-07-02 US disclosed