SCHEMBL5858847

SCHEMBL5858847

CCCCCCCCc1cc(C)ccc1OB(O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 5/20 0.45
MAPT P10636 3/20 0.41
GAA P10253 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALDH1A1 P00352 1/20 0.41
THRB P10828 1/20 0.41
ALOX5 P09917 5/20 0.41
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 2/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.41
TYR P14679 2/20 0.41
TSHR P16473 2/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
PTGS2 P35354 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK1 P28482 1/20 0.40
RAD52 P43351 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
SCHEMBL5859440 1.00 LIPG (0.45) LIPGMAPTGAANPSR1ALDH1A1
SCHEMBL5859430 0.94 MAPT (0.40) LIPGMAPTGAANPSR1ALDH1A1
SCHEMBL6764069 0.82 MTNR1A (0.46) LIPGALDH1A1ALOX5MEN1KMT2A
SCHEMBL5861531 0.82 MTNR1A (0.46) LIPGALDH1A1ALOX5MEN1KMT2A
SCHEMBL11487795 0.82 MAPT (0.46) MAPTGAANPSR1ALDH1A1THRB
SCHEMBL11482268 0.82 MAPT (0.46) MAPTGAANPSR1ALDH1A1THRB
SCHEMBL15186292 0.81 HTR2A (0.53) GAAALOX5TDP1PTGS2L3MBTL1
SCHEMBL3617262 0.80 LIPG (0.46) LIPGMAPTALDH1A1THRBALOX5
SCHEMBL4858367 0.80 LIPG (0.62) LIPGTHRBALOX5PTGS2LPL
SCHEMBL4859387 0.80 LIPG (0.62) LIPGTHRBALOX5PTGS2LPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7087353-B2 Non-contact heat fixing toner KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2006-08-08 US disclosed
US-20040142263-A1 Non-contact heat fixing toner KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. 2004-07-22 US disclosed