SCHEMBL29468643

SCHEMBL29468643

Cc1cccc(OS(=O)(=O)Oc2cccc(C)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.56
PPARG P37231 1/20 0.56
LMNA P02545 1/20 0.52
HTT P42858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
ALDH1A1 P00352 2/20 0.46
GAA P10253 1/20 0.43
F2 P00734 1/20 0.41
KMT2A Q03164 2/20 0.40
LYN P07948 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40

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
SCHEMBL3884174 1.00 ACHE (0.56) ACHEPPARGLMNAHTTTDP1
SCHEMBL3888445 0.94 PPARG (0.59) ACHEPPARGLMNAHTTTDP1
SCHEMBL3887850 0.90 ACHE (0.55) ACHEPPARGLMNAHTTTDP1
SCHEMBL16743488 0.88 KDM4E (0.48) ACHEPPARGLMNAHTTTDP1
SCHEMBL3888828 0.85 PPARG (0.48) ACHEPPARGLMNAHTTTDP1
SCHEMBL4599461 0.85 PPARG (0.58) ACHEPPARGLMNAHTTTDP1
SCHEMBL1532691 0.83 LMNA (0.53) ACHEPPARGLMNAHTTTDP1
SCHEMBL11164410 0.83 PPARG (0.53) ACHEPPARGLMNAHTTTDP1
SCHEMBL19568043 0.83 PPARG (0.53) ACHEPPARGLMNAHTTTDP1
SCHEMBL9451450 0.83 CA2 (0.73) ACHEPPARGCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
US-20220149436-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2022-05-12 US disclosed
US-11283107-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-22 US disclosed