SCHEMBL778657

SCHEMBL778657

CCOP(=O)(C(=O)c1ccccc1C)C(=O)c1ccccc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
THRB P10828 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
TSHR P16473 1/20 0.47
RAB9A P51151 3/20 0.46
MEN1 O00255 3/20 0.46
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
POLB P06746 2/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 2/20 0.42
FFAR1 O14842 1/20 0.42
CHRM1 P11229 1/20 0.41
DRD2 P14416 1/20 0.41
ERCC5 P28715 1/20 0.41

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
SCHEMBL779439 0.86 KMT2A (0.58) KMT2ALMNAMAPTHTTTHRB
SCHEMBL10092049 0.83 KMT2A (0.49) KMT2ALMNAMAPTHTTTHRB
SCHEMBL13773117 0.81 THRB (0.50) KMT2ALMNAMAPTHTTTHRB
SCHEMBL10092061 0.81 ALDH1A1 (0.50) KMT2ALMNAMAPTHTTTHRB
SCHEMBL781190 0.80 NPC1 (0.46) KMT2ALMNAMAPTL3MBTL1RAB9A
SCHEMBL777428 0.77 NPC1 (0.44) KMT2ALMNAMAPTHTTTSHR
SCHEMBL776757 0.77 KMT2A (0.49) KMT2ALMNAMAPTHTTTHRB
SCHEMBL17978252 0.77 KMT2A (0.56) KMT2ALMNAMAPTHTTTHRB
SCHEMBL8397642 0.77 HPGD (0.46) KMT2ALMNAMAPTHTTTHRB
SCHEMBL1549244 0.76 KMT2A (0.48) KMT2ALMNAMAPTHTTTHRB

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