SCHEMBL779060

SCHEMBL779060

CCC(CC)OP(=O)(O)C(=O)c1ccccc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FFAR1 O14842 1/20 0.39
KMT2A Q03164 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
GAA P10253 3/20 0.39
RAB9A P51151 3/20 0.39
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 2/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 3/20 0.39
MAPT P10636 2/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
ERCC5 P28715 1/20 0.37
FEN1 P39748 1/20 0.37
POLB P06746 1/20 0.36
PKM P14618 1/20 0.36
ACP3 P15309 1/20 0.36

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
SCHEMBL779057 0.87 HPGD (0.41) THRBL3MBTL1FFAR1KMT2ASMN1; SMN2
SCHEMBL776756 0.77 KMT2A (0.47) THRBL3MBTL1KMT2ASMN1; SMN2GAA
SCHEMBL779631 0.77 ALDH1A1 (0.40) THRBL3MBTL1KMT2ASMN1; SMN2RAB9A
SCHEMBL777747 0.75 ALDH1A1 (0.42) L3MBTL1KMT2ASMN1; SMN2GAARAB9A
SCHEMBL2258548 0.74 HPGD (0.52) L3MBTL1KMT2ASMN1; SMN2GAARAB9A
SCHEMBL779397 0.74 TSHR (0.49) L3MBTL1KMT2AALDH1A1MEN1MAPT
SCHEMBL776899 0.74 HPGD (0.43) THRBL3MBTL1KMT2ASMN1; SMN2GAA
SCHEMBL778117 0.73 HPGD (0.45) KMT2ASMN1; SMN2GAARAB9AALDH1A1
SCHEMBL3886683 0.73 ALDH1A1 (0.37) THRBL3MBTL1KMT2ARAB9AALDH1A1
SCHEMBL778023 0.72 SMN1; SMN2 (0.41) L3MBTL1SMN1; SMN2RAB9AALDH1A1NPC1

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