SCHEMBL11708331

SCHEMBL11708331

CCCC(C)(O)OC(C)(O)CCC

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
FDPS P14324 1/20 0.36
LMNA P02545 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL19136740 0.84 ALDH1A1 (0.38) ALDH1A1FDPSLMNAHSD17B10
SCHEMBL7780110 0.82 FDPS (0.34) ALDH1A1FDPSLMNA
SCHEMBL161848 0.79
SCHEMBL216315 0.77
SCHEMBL19876061 0.75 ALDH1A1 (0.37) ALDH1A1
SCHEMBL325803 0.73 TSHR (0.38) ALDH1A1
SCHEMBL934833 0.73
SCHEMBL9439975 0.71 FDPS (0.38) ALDH1A1FDPSLMNAHSD17B10
Water SCHEMBL27734811 0.71 TSHR (0.35) ALDH1A1
SCHEMBL155401 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4061680-A CATALYTIC SPLITTING, ALUMINUM OXIDE, CALCIUM PHOSPHATE BART EVGENY VASILIEVICH 1977-12-06 US disclosed