SCHEMBL778305

SCHEMBL778305

Cc1cccc(C(=O)S(C)(=O)=O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.57
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
HPGD P15428 2/20 0.49
KCNK3 O14649 2/20 0.49
KCNK9 Q9NPC2 2/20 0.49
KCNH2 Q12809 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
KAT6A Q92794 1/20 0.47
POLB P06746 2/20 0.47
CNR2 P34972 1/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
RAB9A P51151 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
ENPP3 O14638 1/20 0.44
ALPL P05186 1/20 0.44

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
SCHEMBL780025 0.86 PARP1 (0.59) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL7451926 0.82 PARP1 (0.55) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL777963 0.81 HPGD (0.54) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL777972 0.78 KAT6A (0.57) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL3629113 0.78 PARP1 (0.50) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL7983521 0.77 PARP1 (0.53) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL4031038 0.76 CES1 (0.48) PARP1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL29503529 0.76 PARP1 (0.68) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL186545 0.76 PARP1 (0.68) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL3753879 0.76 PARP1 (0.68) PARP1HDAC8HDAC6SMN1; SMN2MEN1

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