SCHEMBL779509

SCHEMBL779509

O=S(=O)(O)c1ccccc1C(C(F)(F)F)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 9/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MYC P01106 1/20 0.38
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SLC22A12 Q96S37 4/20 0.37
ALDH1A1 P00352 1/20 0.36
TTR P02766 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA5A P35218 1/20 0.35
CA9 Q16790 1/20 0.35
KAT6A Q92794 1/20 0.35

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
SCHEMBL778821 0.84 HSD11B1 (0.41) HSD11B1MEN1KMT2AMYCTSHR
SCHEMBL5473250 0.84 HSD11B1 (0.41) HSD11B1MEN1KMT2AMYCTSHR
SCHEMBL29624178 0.83 KMT2A (0.56) HSD11B1MEN1KMT2ASLC22A12ALDH1A1
SCHEMBL247640 0.83 KMT2A (0.56) HSD11B1MEN1KMT2ASLC22A12ALDH1A1
SCHEMBL3783669 0.82 KMT2A (0.55) HSD11B1MEN1KMT2ASLC22A12ALDH1A1
SCHEMBL780317 0.82 MYC (0.43) HSD11B1MEN1KMT2AMYCTSHR
SCHEMBL28361718 0.82 KMT2A (0.55) HSD11B1MEN1KMT2ASLC22A12ALDH1A1
Hydrochloric Acid SCHEMBL4303729 0.82 KMT2A (0.55) HSD11B1MEN1KMT2ASLC22A12ALDH1A1
Ammonia Solution, Strong SCHEMBL5470277 0.82 KMT2A (0.55) HSD11B1MEN1KMT2ASLC22A12ALDH1A1
SCHEMBL16340978 0.82 KMT2A (0.55) HSD11B1MEN1KMT2ASLC22A12ALDH1A1

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