SCHEMBL6670098

SCHEMBL6670098

CCCCOc1cccc(COC(=O)c2ccc(C(=O)OCc3cccc(OCCCC)c3)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.58
TDP1 Q9NUW8 3/20 0.58
CYP2D6 P10635 5/20 0.54
MAPK1 P28482 4/20 0.54
TSHR P16473 4/20 0.54
LMNA P02545 2/20 0.54
CYP1A2 P05177 2/20 0.54
CYP2C19 P33261 2/20 0.54
ESR1 P03372 1/20 0.54
NR1H2 P55055 1/20 0.54
RNASEL Q05823 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CYP3A4 P08684 2/20 0.51
ALDH1A1 P00352 1/20 0.51
PLA2G4B P0C869 3/20 0.51
THRB P10828 1/20 0.50
KCNH2 Q12809 1/20 0.49
KMT2A Q03164 1/20 0.49
CYP2C9 P11712 1/20 0.49
PDE4D Q08499 1/20 0.49

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
SCHEMBL20830910 0.86 TSHR (0.65) L3MBTL1TDP1CYP2D6MAPK1TSHR
SCHEMBL20830500 0.83 TSHR (0.62) L3MBTL1TDP1CYP2D6MAPK1TSHR
SCHEMBL9343792 0.83 TDP1 (0.58) L3MBTL1TDP1MAPK1TSHRLMNA
SCHEMBL18736535 0.80 TDP1 (0.55) L3MBTL1TDP1MAPK1TSHRCYP3A4
SCHEMBL13481158 0.80 KMT2A (0.63) L3MBTL1TDP1MAPK1TSHRLMNA
SCHEMBL11416620 0.80 TSHR (0.78) L3MBTL1TDP1CYP2D6MAPK1TSHR
SCHEMBL17961071 0.80 KMT2A (0.60) L3MBTL1TDP1CYP2D6MAPK1TSHR
SCHEMBL15613593 0.80 L3MBTL1 (0.67) L3MBTL1TDP1CYP2D6MAPK1TSHR
SCHEMBL11050996 0.78 KDM4E (0.60) L3MBTL1TDP1CYP2D6MAPK1TSHR
SCHEMBL18542249 0.78 L3MBTL1 (0.82) L3MBTL1TDP1CYP2D6MAPK1TSHR

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
EP-1004621-B1 GAMMA-RAY STABILIZER AND THERMOPLASTIC POLYMER COMPOSITION CONTAINING THE SAME TEIJIN CHEMICALS LTD (JP) 2004-09-15 EP disclosed
US-6485657-B1 Gamma-ray stabilizer and thermoplastic polymer compound including the said stabilizer TEIJIN, LIMITED (JP) 2002-11-26 US disclosed
EP-1004621-A1 GAMMA-RAY STABILIZER AND THERMOPLASTIC POLYMER COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 2000-05-31 EP disclosed