SCHEMBL779323

SCHEMBL779323

CCOP(=O)(C(=O)c1ccc(C)cc1)C(=O)c1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
MAPT P10636 1/20 0.49
LMNA P02545 2/20 0.48
GAA P10253 2/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
SRD5A2 P31213 2/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GSK3B P49841 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MMP13 P45452 1/20 0.40
POLB P06746 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
SCHEMBL779782 0.85 ALDH1A1 (0.59) ALDH1A1MAPTLMNAGAACES2
SCHEMBL10092065 0.80 MAPT (0.48) ALDH1A1MAPTLMNAGAACES2
SCHEMBL779854 0.80 HPGD (0.53) ALDH1A1MAPTGAAKMT2AMEN1
SCHEMBL14105717 0.79 ALDH1A1 (0.49) ALDH1A1MAPTLMNAGAACES2
SCHEMBL778214 0.79 ALDH1A1 (0.54) ALDH1A1MAPTLMNAGAACES2
SCHEMBL10092167 0.77 MEN1 (0.54) ALDH1A1MAPTLMNAGAACES2
SCHEMBL777317 0.76 TDP1 (0.53) ALDH1A1MAPTLMNAGAACES2
SCHEMBL781343 0.75 ALDH1A1 (0.46) ALDH1A1MAPTLMNAGAACES2
SCHEMBL12512733 0.75 KMT2A (0.49) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL781342 0.74 ALDH1A1 (0.44) ALDH1A1MAPTLMNAGAACES2

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