SCHEMBL775656

SCHEMBL775656

O=S(O)(O)(c1ccccc1)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.38
PTPN1 P18031 1/20 0.37
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
CA5A P35218 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
PTPN5 P54829 1/20 0.32
MMP2 P08253 1/20 0.32
DBH P09172 1/20 0.32
PGK1 P00558 2/20 0.30
PGK2 P07205 2/20 0.30
KDM4E B2RXH2 1/20 0.30
CA12 O43570 1/20 0.30
HMGB1 P09429 1/20 0.30
HPGD P15428 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA7 P43166 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
SCHEMBL776323 0.82 CES1 (0.35) CES1PTPN1ALDH1A1TSHRPTPN5
SCHEMBL778297 0.82 CES1 (0.35) CES1PTPN1ALDH1A1TSHRPTPN5
SCHEMBL776947 0.79 CES1 (0.33) CES1PTPN1ALDH1A1TSHR
SCHEMBL775619 0.77 CES1 (0.32) CES1PTPN1
SCHEMBL777901 0.73 TSHR (0.35) ALDH1A1TSHRSMN1; SMN2
SCHEMBL5042529 0.72 CES1 (0.33) CES1PTPN1CA1CA2CA9
SCHEMBL778850 0.71 CES1 (0.34) CES1PTPN1ALDH1A1TSHRPTPN5
SCHEMBL776409 0.71 CES1 (0.35) CES1PTPN1ALDH1A1TSHRSMN1; SMN2
SCHEMBL278265 0.71 TSHR (0.39) CES1CA1CA2CA9CA5A
SCHEMBL10639940 0.71 NPSR1 (0.38) CES1CA1CA2CA9CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 US disclosed
US-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed