SCHEMBL9717237

SCHEMBL9717237

CCCOC(=O)/C=C(/O)C(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.52
HCAR2 Q8TDS4 5/20 0.50
ATM Q13315 1/20 0.39
GLO1 Q04760 1/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP2D6 P10635 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 2/20 0.37
HPGD P15428 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36
LMNA P02545 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
FAAH O00519 2/20 0.34
APP P05067 1/20 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
SCHEMBL19592213 1.00 NPSR1 (0.52) NPSR1HCAR2ATMGLO1ALDH1A1
SCHEMBL2288560 0.88 NPSR1 (0.65) NPSR1HCAR2GLO1ALDH1A1CYP2D6
SCHEMBL4205886 0.88 NPSR1 (0.65) NPSR1HCAR2GLO1ALDH1A1CYP2D6
SCHEMBL2288565 0.88 NPSR1 (0.65) NPSR1HCAR2GLO1ALDH1A1CYP2D6
SCHEMBL28912588 0.86 NPSR1 (0.63) NPSR1HCAR2GLO1ALDH1A1CYP2D6
SCHEMBL28855755 0.86 NPSR1 (0.63) NPSR1HCAR2GLO1ALDH1A1CYP2D6
SCHEMBL30000293 0.86 NPSR1 (0.63) NPSR1HCAR2GLO1ALDH1A1CYP2D6
SCHEMBL9717298 0.85 ATM (0.55) NPSR1HCAR2ATMALDH1A1TSHR
SCHEMBL8642959 0.85 HCAR2 (0.50) NPSR1HCAR2ATMALDH1A1CYP2D6
SCHEMBL8642958 0.81 HCAR2 (0.46) NPSR1HCAR2ATMALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0445219-A4 SILSESQUIOXANE OLIGOMERS AND OPTICAL GLASS FIBER COATING COMPOSITIONS CONTAINING THE SAME 1992-01-15 EP disclosed
WO-1991017198-A1 LIQUID COMPOSITION COMPRISING SILICONE OLIGOMERS STAMICARBON B.V. (NL) 1991-11-14 WO disclosed
EP-0445219-A1 SILSESQUIOXANE OLIGOMERS AND OPTICAL GLASS FIBER COATING COMPOSITIONS CONTAINING THE SAME DESOTO INC. (US) 1991-09-11 EP disclosed
WO-1990005752-A1 SILSESQUIOXANE OLIGOMERS AND OPTICAL GLASS FIBER COATING COMPOSITIONS CONTAINING THE SAME DESOTO, INC. (US) 1990-05-31 WO disclosed