SCHEMBL780499

SCHEMBL780499

Cc1ccc(C(=O)c2cc(S(=O)(=O)O)ccc2C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
HPGD P15428 3/20 0.48
HSD17B10 Q99714 2/20 0.48
CYP1A2 P05177 1/20 0.48
LMNA P02545 3/20 0.47
SNCA P37840 1/20 0.45
AKR1C3 P42330 1/20 0.44
MAPT P10636 3/20 0.43
HTT P42858 2/20 0.43
TP53 P04637 1/20 0.43
KMT2A Q03164 1/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP2C9 P11712 1/20 0.43
KDM4E B2RXH2 1/20 0.42
RAPGEF4 Q8WZA2 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MCOLN3 Q8TDD5 1/20 0.42
SRD5A2 P31213 1/20 0.42
PTGS2 P35354 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
SCHEMBL11526913 0.95 ALDH1A1 (0.46) ALDH1A1HPGDHSD17B10CYP1A2LMNA
SCHEMBL10112765 0.90 MAPT (0.45) ALDH1A1HPGDHSD17B10CYP1A2LMNA
SCHEMBL11033531 0.87 PTGS2 (0.55) ALDH1A1HPGDHSD17B10CYP1A2LMNA
SCHEMBL5611564 0.86 ALDH1A1 (0.57) ALDH1A1HPGDHSD17B10CYP1A2LMNA
SCHEMBL11526756 0.84 PTGS2 (0.45) ALDH1A1HPGDHSD17B10CYP1A2LMNA
SCHEMBL778632 0.83 POLB (0.51) ALDH1A1HPGDHSD17B10CYP1A2MAPT
SCHEMBL13671429 0.83 MMP13 (0.43) ALDH1A1HPGDHSD17B10CYP1A2MAPT
SCHEMBL9782367 0.81 ALDH1A1 (0.60) ALDH1A1LMNAAKR1C3MAPTHTT
SCHEMBL12228348 0.80 GFER (0.42) ALDH1A1HPGDHSD17B10CYP1A2LMNA
SCHEMBL10112764 0.80 POLB (0.44) ALDH1A1HPGDHSD17B10CYP1A2LMNA

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 4 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