SCHEMBL1963286

SCHEMBL1963286

CCCCCCCCc1c(N)ccc(C(=O)c2ccccc2)c1CCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
GAA P10253 1/20 0.45
POLB P06746 2/20 0.43
CES2 O00748 2/20 0.43
CES1 P23141 2/20 0.43
NAAA Q02083 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CNR2 P34972 1/20 0.41
PPARA Q07869 1/20 0.40
RARB P10826 1/20 0.39
PLK1 P53350 3/20 0.39
PLK3 Q9H4B4 3/20 0.39
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 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
SCHEMBL17420726 0.94 MAPT (0.47) MAPTGAAPOLBCES2CES1
SCHEMBL9516289 0.84 PPARA (0.51) MAPTALDH1A1PPARARARBPLK1
SCHEMBL27804906 0.84 PPARA (0.51) MAPTALDH1A1PPARARARBPLK1
SCHEMBL29291134 0.83 CES2 (0.43) CES2CES1NAAACNR2PPARA
SCHEMBL27832902 0.83 RARB (0.45) CES2CES1NAAACNR2PPARA
SCHEMBL11699273 0.83 CNR2 (0.43) CES2CES1NAAAALDH1A1CNR2
SCHEMBL27825558 0.82 PPARA (0.49) MAPTALDH1A1PPARARARBPLK1
SCHEMBL11652259 0.81 MAPT (0.42) MAPTGAAPOLBCES2CES1
SCHEMBL8672001 0.81 KAT8 (0.56) MAPTGAAPOLBCES2CES1
SCHEMBL28428779 0.80 CNR2 (0.43) CES2CES1NAAAALDH1A1CNR2

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
EP-2334727-A1 POLYOLEFIN COMPOSITION FOR MEDIUM/HIGH/EXTRA HIGH VOLTAGE CABLES COMPRISING BENZOPHENONE-TYPE VOLTAGE STABILIZER Borealis AG (AT) 2011-06-22 EP disclosed
WO-2010028721-A1 POLYOLEFIN COMPOSITION FOR MEDIUM/HIGH/EXTRA HIGH VOLTAGE CABLES COMPRISING BENZOPHENONE-TYPE VOLTAGE STABILIZER BOREALIS AG (AT) 2010-03-18 WO disclosed