SCHEMBL27928016

SCHEMBL27928016

CC(C)(P=O)C(F)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PTGS1 P23219 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL7279241 0.73
SCHEMBL3520756 0.73 TSHR (0.37) ALDH1A1MAPTPTGS1TSHR
SCHEMBL1708138 0.70
SCHEMBL27742869 0.70
SCHEMBL27601379 0.70
SCHEMBL28976446 0.69 ALDH1A1 (0.33) ALDH1A1MAPTPTGS1TSHR
SCHEMBL21295105 0.67 ALDH1A1 (0.36) ALDH1A1MAPTPTGS1TSHR
SCHEMBL27783691 0.65 MAPT (0.35) ALDH1A1MAPTPTGS1TSHR
SCHEMBL27477795 0.65 ALDH1A1 (0.35) ALDH1A1MAPTPTGS1TSHR
SCHEMBL4821291 0.64

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
CN-103460495-B Nonaqueous electrolytic solution and employ the electric energy storage device of this nonaqueous electrolytic solution UBE INDUSTRIES, LTD. (JP) 2016-01-27 CN disclosed
CN-103460495-A Non-aqueous electrolyte solution and electricity-storage device using same UBE INDUSTRIES 2013-12-18 CN disclosed