SCHEMBL16865197

SCHEMBL16865197

C=CC1CC1(C(=O)OC)S(C)(=O)=O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL15024695 0.76 CYP3A4 (0.50) NPSR1
SCHEMBL16865159 0.76 NPSR1 (0.39) NPSR1
SCHEMBL11896924 0.72 MAPT (0.33) NPSR1
SCHEMBL812061 0.72 MAPT (0.33) NPSR1
SCHEMBL12530121 0.72 MAPT (0.33) NPSR1
SCHEMBL8434138 0.71 CYP3A4 (0.35) NPSR1
SCHEMBL3281207 0.71 CYP3A4 (0.35) NPSR1
SCHEMBL13090500 0.71 NPSR1 (0.31) NPSR1
SCHEMBL15483710 0.71 CYP3A4 (0.35) NPSR1
SCHEMBL11976380 0.71 CYP3A4 (0.35) 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 2 patents. 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
US-20150188193-A1 NON-AQUEOUS LIQUID ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY FUJIFILM CORPORATION (JP) 2015-07-02 US disclosed