SCHEMBL6436093

SCHEMBL6436093

CCCC(O)C(O)C(O)CCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.35
MGAM O43451 1/20 0.34
CYP2D6 P10635 2/20 0.32
SPHK1 Q9NYA1 2/20 0.32
GMNN O75496 1/20 0.32
POLB P06746 1/20 0.32
THPO P40225 1/20 0.32
MTOR P42345 1/20 0.32
BLM P54132 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
CETP P11597 1/20 0.32
HTT P42858 1/20 0.32
UBE2N P61088 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL4819539 0.88 LMNA (0.52) LMNATSHRTHRBCYP2D6SPHK1
SCHEMBL15484277 0.85 THRB (0.44) LMNATHRBALDH1A1L3MBTL1TDP1
SCHEMBL6839625 0.84 TSHR (0.41) LMNATSHRMGAMALDH1A1
SCHEMBL17108622 0.83 LMNA (0.54) LMNATSHRMGAMCYP2D6SPHK1
SCHEMBL14147721 0.83 LMNA (0.54) LMNATSHRMGAMCYP2D6SPHK1
SCHEMBL15044040 0.83 LMNA (0.37) LMNATSHRTHRBL3MBTL1TDP1
SCHEMBL13296277 0.83 LMNA (0.54) LMNATSHRMGAMCYP2D6SPHK1
SCHEMBL15895084 0.83 LMNA (0.37) LMNATSHRTHRBL3MBTL1TDP1
SCHEMBL18136267 0.83 LMNA (0.37) LMNATSHRTHRBL3MBTL1TDP1
SCHEMBL2991748 0.83 LMNA (0.54) LMNATSHRMGAMCYP2D6SPHK1

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
EP-1786475-B1 1,4-BIS(CARBOXYMETHYL)-6-[BIS(CARBOXYMETHYL)AMINO]-6-METHYL-PERHYDRO-1,4-DIAZEPINE (AAZTA) DERIVATIVES AS LIGANDS IN HIGH RELAXIVITY CONTRAST AGENTS FOR USE IN MAGNETIC RESONANCE IMAGING (MRI) BRACCO IMAGING SPA (IT) 2009-04-29 EP disclosed
EP-1172400-B1 THERMOPLASTIC RESIN FILM WITH SATISFACTORY PRINTABILITY YUPO CORP (JP) 2005-12-28 EP disclosed
US-6586106-B2 Ink transfer, adhesion and aging stability, and being satisfactory in back ghost when offset printing using oxidation polymerization type ink is performed on both faces YUPO CORPORATION (JP) 2003-07-01 US disclosed
US-20020054991-A1 Thermoplastic resin film satisfactory in printability YUPO CORPORATION (JP) 2002-05-09 US disclosed
EP-1172400-A1 THERMOPLASTIC RESIN FILM WITH SATISFACTORY PRINTABILITY Yupo Corporation (JP) 2002-01-16 EP disclosed