SCHEMBL3133697

SCHEMBL3133697

CCOP(=O)(F)OC.CCOP(=O)(F)OCC

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
FAAH O00519 1/20 0.37
PPARD Q03181 2/20 0.36
ACHE P22303 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL576372 0.97
SCHEMBL3130454 0.90 TSHR (0.42) TSHRTP53TDP1FAAHPPARD
SCHEMBL575446 0.89
SCHEMBL3121986 0.81 TSHR (0.48) TSHRTP53TDP1PPARD
SCHEMBL28702593 0.81 TSHR (0.48) TSHRTP53TDP1PPARDACHE
SCHEMBL575640 0.77 TSHR (0.43) TSHRTP53TDP1PPARDMEN1
SCHEMBL575509 0.77
SCHEMBL3130181 0.76 TSHR (0.48) TSHRTP53TDP1FAAHPPARD
SCHEMBL3702687 0.73 TP53 (0.42) TSHRTP53TDP1PPARD
SCHEMBL575802 0.73 CYP3A4 (0.56) TSHRFAAHMEN1KMT2A

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-1204157-B1 Electrolyte for non-aqueous batteries and secondary battery using the same PANASONIC CORP (JP) 2010-03-24 EP disclosed