SCHEMBL776571

SCHEMBL776571

Cc1ccc(S(=O)(=O)O)c(-c2cccc(F)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALOX15 P16050 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
HPGD P15428 2/20 0.44
HSP90AA1 P07900 1/20 0.44
ACHE P22303 1/20 0.43
TP53 P04637 1/20 0.42
THRB P10828 1/20 0.42
PTPN1 P18031 1/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
NFKB1 P19838 1/20 0.42
CASP1 P29466 1/20 0.42
CASP3 P42574 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
KMT2A Q03164 1/20 0.42
RELA Q04206 1/20 0.42
SENP8 Q96LD8 1/20 0.42

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
SCHEMBL3885747 0.87 MAOB (0.42) MAPTSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL778648 0.86 MAOA (0.35) MAPTSMN1; SMN2ALOX15NPSR1HPGD
SCHEMBL8820277 0.83 HDAC7 (0.41) MAPTHPGDPTPN1MEN1KMT2A
SCHEMBL6236657 0.83 CHRM1 (0.43) SMN1; SMN2NPSR1HSP90AA1RAB9AKMT2A
SCHEMBL778954 0.83 PTGS2 (0.42) ALOX15ACHEMEN1NPC1RAB9A
SCHEMBL3151094 0.82 HDAC7 (0.49) MAPTSMN1; SMN2NPSR1HPGDHSP90AA1
SCHEMBL778996 0.81 PTPN1 (0.46) MAPTSMN1; SMN2ALOX15TP53PTPN1
SCHEMBL8082279 0.80 MAOA (0.41) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL28689298 0.80 PTGS2 (0.45) MAPTSMN1; SMN2ACHEMEN1KMT2A
SCHEMBL30368404 0.79 KDM4E (0.35) MAPTSMN1; SMN2NPSR1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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