SCHEMBL776757

SCHEMBL776757

CCCOP(=O)(OCCC)C(=O)c1ccccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.43
THRB P10828 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 3/20 0.41
TSHR P16473 3/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
F2R P25116 1/20 0.40
ERCC5 P28715 1/20 0.39
FEN1 P39748 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL777395 0.91 TSHR (0.49) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL4610958 0.90 KMT2A (0.48) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL779061 0.89 TSHR (0.50) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL779439 0.87 KMT2A (0.58) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL776756 0.86 KMT2A (0.47) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL778708 0.82 KDM4E (0.43) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL4609601 0.79 ALDH1A1 (0.47) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL4611005 0.79 KMT2A (0.42) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL4609527 0.79 SMN1; SMN2 (0.50) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL4609994 0.78 KMT2A (0.41) KMT2AMEN1ALDH1A1LMNAMAPT

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