SCHEMBL10180733

SCHEMBL10180733

O=C(Oc1cc(F)c(F)c(F)c1)C(F)(F)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA4 P22748 2/20 0.32
MAOB P27338 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
SCHEMBL10181736 0.84 CES2 (0.41) CES2CES1CA1CA2CA4
SCHEMBL24901030 0.83 CES2 (0.38) CES2CES1CA1CA2CA4
SCHEMBL10180105 0.82 CYP4F2 (0.40) CES2CES1CA1CA2
SCHEMBL10181495 0.81 CES2 (0.38) CES2CES1CA1CA2MAOB
SCHEMBL10180644 0.78 CES2 (0.32) CES2CES1CA1CA2CA4
SCHEMBL10179988 0.77 CES2 (0.40) CES2CES1
SCHEMBL21810571 0.74 CES2 (0.48) CES2CES1CA1CA2CA4
SCHEMBL10180496 0.74 ELANE (0.42) CES2CES1
SCHEMBL10180426 0.73 GABRA1 (0.33)
SCHEMBL10180361 0.73 CES2 (0.35) CES2CES1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130244122-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME ONUKI MASAMICHI (JP) 2013-09-19 US disclosed
US-20120219866-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-30 US disclosed
EP-2475041-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE BATTERY COMPRISING SAME Mitsubishi Chemical Corporation (JP) 2012-07-11 EP disclosed