SCHEMBL3883336

SCHEMBL3883336

CCOS(=O)Oc1cccc(C)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.46
LMNA P02545 2/20 0.43
TDP1 Q9NUW8 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 2/20 0.38
GAA P10253 2/20 0.38
HTT P42858 2/20 0.37
MAPT P10636 1/20 0.37
MAOB P27338 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL3896460 0.85 ACHE (0.56) ACHELMNATDP1L3MBTL1ALDH1A1
SCHEMBL29468656 0.85 ACHE (0.56) ACHELMNATDP1L3MBTL1ALDH1A1
SCHEMBL778553 0.81 PPARG (0.40) ALDH1A1MAPTMAOBRAB9A
SCHEMBL3883831 0.80 ACHE (0.55) ACHELMNATDP1L3MBTL1ALDH1A1
SCHEMBL3883005 0.80 ACHE (0.50) ACHELMNATDP1L3MBTL1ALDH1A1
SCHEMBL11221419 0.80 LTA4H (0.41) TDP1L3MBTL1MAPTRAB9A
SCHEMBL27769975 0.79 TDP1 (0.50) ACHELMNATDP1L3MBTL1ALDH1A1
SCHEMBL3887583 0.78 ACHE (0.38) ACHELMNAL3MBTL1ALDH1A1KMT2A
SCHEMBL16804121 0.76 ACHE (0.54) ACHELMNATDP1L3MBTL1ALDH1A1
SCHEMBL4132638 0.74 LMNA (0.53) ACHELMNATDP1L3MBTL1ALDH1A1

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-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 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