SCHEMBL4340968

SCHEMBL4340968

O=C1OCC(CS(=O)(=O)Oc2ccc(Cl)cc2)O1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.46
CA1 P00915 6/20 0.46
CA9 Q16790 6/20 0.46
CA12 O43570 4/20 0.37
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PPARG P37231 1/20 0.35
GRM2 Q14416 1/20 0.34
STS P08842 1/20 0.34
NFE2L2 Q16236 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
MMP2 P08253 1/20 0.33
MMP7 P09237 1/20 0.33
MMP9 P14780 1/20 0.33

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
SCHEMBL4338776 0.86 CA2 (0.41) CA2CA1CA9CA12ALDH1A1
SCHEMBL558095 0.86 CA2 (0.43) CA2CA1CA9ALDH1A1TDP1
SCHEMBL557609 0.72 CA2 (0.31) CA2CA1
SCHEMBL558096 0.72 ALDH1A1 (0.41) CA2CA1CA9ALDH1A1TDP1
SCHEMBL557664 0.70 CA2 (0.36) CA2CA1
SCHEMBL13666940 0.70 CA2 (0.30) CA2
SCHEMBL558029 0.69 CA2 (0.49) CA2CA1CA9CA12MAOA
SCHEMBL557577 0.69
SCHEMBL558089 0.69 CA1 (0.43) CA2CA1CA9CA12
SCHEMBL8156243 0.68 SLC6A4 (0.37) CA2CA1CA9GRM2MAOA

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-20220069353-A1 Electrolyte Solution For Lithium Secondary Battery And Lithium Secondary Battery Including The Same LG ENERGY SOLUTION, LTD. (KR) 2022-03-03 US claimed
EP-3883036-A1 ELECTROLYTE FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY COMPRISING SAME LG ENERGY SOLUTION, LTD. (KR) 2021-09-22 EP claimed
US-20090280414-A1 Additive for non-aqueous electrolyte and secondary battery using the same LG CHEM, LTD. (KR) 2009-11-12 US claimed
US-20220069353-A1 Electrolyte Solution For Lithium Secondary Battery And Lithium Secondary Battery Including The Same LG ENERGY SOLUTION, LTD. (KR) 2022-03-03 US disclosed
EP-3883036-A1 ELECTROLYTE FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY COMPRISING SAME LG ENERGY SOLUTION, LTD. (KR) 2021-09-22 EP disclosed
US-8349502-B2 Additive for non-aqueous electrolyte and secondary battery using the same LG CHEM, LTD. (KR) 2013-01-08 US disclosed
US-20090280414-A1 Additive for non-aqueous electrolyte and secondary battery using the same LG CHEM, LTD. (KR) 2009-11-12 US disclosed