SCHEMBL778216

SCHEMBL778216

Cc1ccccc1C(=O)S(C)(=O)(O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.44
ERCC5 P28715 1/20 0.43
FEN1 P39748 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
BCHE P06276 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
MYC P01106 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
ELANE P08246 1/20 0.40
TYK2 P29597 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
SCHEMBL778700 0.85 HPGD (0.46) HPGDERCC5FEN1NPC1RAB9A
SCHEMBL776603 0.79 HPGD (0.44) HPGDERCC5FEN1NPC1RAB9A
SCHEMBL780060 0.79 ERCC5 (0.43) HPGDERCC5FEN1NPC1RAB9A
SCHEMBL8686409 0.73 HPGD (0.50) HPGDERCC5FEN1HTTSMN1; SMN2
SCHEMBL1596859 0.73 HPGD (0.50) HPGDERCC5FEN1HTTSMN1; SMN2
SCHEMBL29538974 0.73 HPGD (0.50) HPGDERCC5FEN1HTTSMN1; SMN2
SCHEMBL166603 0.72 HPGD (0.54) HPGDERCC5FEN1HTTSMN1; SMN2
SCHEMBL29425530 0.72 HPGD (0.54) HPGDERCC5FEN1HTTSMN1; SMN2
SCHEMBL333141 0.72 CYP3A4 (0.55) HPGDERCC5FEN1BCHEHTT
SCHEMBL29387256 0.72 CYP3A4 (0.55) HPGDERCC5FEN1BCHEHTT

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