SCHEMBL8748516

SCHEMBL8748516

C/C=C/COCCCCO

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
MEN1 O00255 1/20 0.35
THRB P10828 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.34
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL6062833 1.00 GAA (0.37) GAAMEN1THRBHTTKMT2A
SCHEMBL30415575 0.98 GAA (0.40) GAAMEN1THRBHTTKMT2A
SCHEMBL30415787 0.98 GAA (0.40) GAAMEN1THRBHTTKMT2A
SCHEMBL6062037 0.93
SCHEMBL11109541 0.85 LSS (0.32) MEN1THRBHTTKMT2AMAPT
SCHEMBL3241237 0.85 LSS (0.32) MEN1THRBHTTKMT2AMAPT
SCHEMBL8835716 0.83
SCHEMBL1325789 0.83
SCHEMBL12073489 0.83
SCHEMBL5603650 0.81

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
US-5661206-A MODIFYING THE FLUIDITY BY ADDING OXYALKYLENE BASED DEFOAMING AGENT; EXTENDED SHELF-LIFE MBT HOLDING AG (CH) 1997-08-26 US disclosed
EP-0754685-A2 Derivatives from alkoxyalkoxy substituted nitrogen containing hetero rings Rolic AG (CH) 1997-01-22 EP disclosed