SCHEMBL18631982

SCHEMBL18631982

O=S(O)Oc1cccc(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.41
CES1 P23141 4/20 0.41
BCHE P06276 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
EGLN1 Q9GZT9 1/20 0.36
KMT2A Q03164 2/20 0.33
TRPA1 O75762 1/20 0.33
HPGD P15428 1/20 0.33
GRM2 Q14416 2/20 0.32
SLC2A1 P11166 1/20 0.32
SLC2A4 P14672 1/20 0.32
PARP10 Q53GL7 1/20 0.32
CXCL8 P10145 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
SCHEMBL31618991 0.83 PARP10 (0.41) CES2CES1KMT2AHPGDPARP10
SCHEMBL778368 0.83 SLC6A2 (0.43) CES2CES1BCHESLC6A2SLC6A4
SCHEMBL18632044 0.83 PARP10 (0.41) CES2CES1KMT2AHPGDPARP10
SCHEMBL4133241 0.81 KMT2A (0.35) CES2CES1SLC6A2SLC6A4SLC6A3
SCHEMBL4121075 0.81 MRGPRX4 (0.35) KMT2A
SCHEMBL4138647 0.78 GABRA1 (0.39) KMT2AHPGDCXCL8
SCHEMBL777627 0.77 SLC6A2 (0.39) CES2CES1BCHESLC6A2SLC6A4
SCHEMBL4135123 0.77 TTR (0.42) KMT2ACXCL8
SCHEMBL4135193 0.77 ALDH1A1 (0.36) KMT2AHPGD
SCHEMBL4122495 0.77 TDP1 (0.37) SLC6A4SLC6A3HPGD

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
EP-3621141-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2020-03-11 EP disclosed
US-10333172-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-25 US disclosed
US-10290901-B2 2019-05-14 US disclosed
US-20170084955-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-23 US disclosed
CN-103259044-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery MITSUBISHI CHEMICAL CORP. (JP) 2016-02-10 CN disclosed
CN-102097654-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery MITSUBISHI CHEMICAL CORP. (JP) 2014-10-01 CN disclosed
CN-103259044-A Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery MITSUBISHI CHEM CORP 2013-08-21 CN disclosed