SCHEMBL27878788

SCHEMBL27878788

C#CC(C)OC(=O)CCCCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.61
MAPT P10636 3/20 0.53
MAPK1 P28482 3/20 0.53
ALDH1A1 P00352 1/20 0.50
PRKCA P17252 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCD Q05655 1/20 0.46
DGKA P23743 1/20 0.46
CYP1A2 P05177 3/20 0.44
MEN1 O00255 1/20 0.43
GMNN O75496 1/20 0.43
HSP90AA1 P07900 1/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
TP53 P04637 1/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL9100884 0.92 LMNA (0.48) LMNAMAPTMAPK1ALDH1A1PRKCA
SCHEMBL10009455 0.88 LMNA (0.44) LMNAMAPTMAPK1ALDH1A1PRKCA
SCHEMBL3487938 0.86 ALDH1A1 (0.44) LMNAMAPTMAPK1ALDH1A1PRKCA
SCHEMBL10011350 0.85 TSHR (0.44) LMNAMAPTALDH1A1CYP1A2MEN1
SCHEMBL10010582 0.84 LMNA (0.38) LMNAMAPTMAPK1MEN1KMT2A
SCHEMBL10012780 0.84 MAPT (0.46) LMNAMAPTMAPK1ALDH1A1PRKCA
SCHEMBL10011971 0.84 LMNA (0.46) LMNAMAPTALDH1A1CYP1A2MEN1
SCHEMBL10010035 0.82 LMNA (0.41) LMNAMAPTMAPK1ALDH1A1PRKCA
SCHEMBL30301319 0.82 MAPT (0.48) LMNAMAPTMAPK1ALDH1A1PRKCA
SCHEMBL10011666 0.81 LMNA (0.39) LMNAMAPTMAPK1ALDH1A1MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104795595-A Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES 2015-07-22 CN disclosed
CN-102498605-B Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES 2015-05-20 CN disclosed
CN-102498605-A Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES 2012-06-13 CN disclosed