SCHEMBL4345145

SCHEMBL4345145

O=C(OCC(F)CF)OCC(F)CF

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL4345148 0.82
SCHEMBL15012903 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL25822842 0.80
SCHEMBL575115 0.79 ALDH1A1 (0.33) ALDH1A1
SCHEMBL23000062 0.77 ALDH1A1 (0.43) ALDH1A1
SCHEMBL575284 0.77 ALDH1A1 (0.43) ALDH1A1
SCHEMBL27945535 0.77 NAAA (0.38) ALDH1A1
SCHEMBL320430 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL321648 0.74 ALDH1A1 (0.33) ALDH1A1
SCHEMBL575219 0.73 HTT (0.37)

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-20090253044-A1 Nonaqueous Electrolyte and Lithium ion Secondary Battery Using Same MITSUI CHEMICALS, INC. (JP) 2009-10-08 US disclosed