SCHEMBL4397259

SCHEMBL4397259

CCCCCCCCCCCCCCCCOC[C@H](O)[C@H]1OC(O)=C(O)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
HSPD1 P10809 1/20 0.45
HSPE1 P61604 1/20 0.45
TST Q16762 1/20 0.45
MAPT P10636 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
LPAR5 Q9H1C0 4/20 0.43
USP2 O75604 1/20 0.42
HTT P42858 1/20 0.41
LPAR1 Q92633 5/20 0.39
LPAR3 Q9UBY5 5/20 0.39
SPHK1 Q9NYA1 1/20 0.38
PLA2G2C Q5R387 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
CES2 O00748 1/20 0.34
LPAR6 P43657 3/20 0.34

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
SCHEMBL10478307 0.81 MAPT (0.67) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL1934664 0.81 MAPT (0.67) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL11381977 0.81 MAPT (0.67) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL1197734 0.81 MAPT (0.67) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL20875134 0.81 MAPT (0.67) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL20875130 0.81 MAPT (0.67) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL23356552 0.81 MAPT (0.70) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL285433 0.81 MAPT (0.70) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL7867820 0.80 MAPT (0.65) TDP1HSPD1HSPE1TSTMAPT
SCHEMBL4388035 0.74 MAPT (0.55) TDP1HSPD1HSPE1TSTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629424-B2 Metal-containing compositions and method of making same PRYOG, LLC (US) 2009-12-08 US claimed
US-20080015278-A1 Metal-Containing Compositions and Method of Making Same PRYOG, LLC 2008-01-17 US claimed
WO-2007070092-A2 METAL-CONTAINING COMPOSITIONS AND METHOD OF MAKING SAME PRYOG, LLC (US) 2007-06-21 WO claimed
US-7629424-B2 Metal-containing compositions and method of making same PRYOG, LLC (US) 2009-12-08 US disclosed
US-20080015278-A1 Metal-Containing Compositions and Method of Making Same PRYOG, LLC 2008-01-17 US disclosed