SCHEMBL10932207

SCHEMBL10932207

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
HCAR2 Q8TDS4 1/20 0.42
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
ALDH1A1 P00352 4/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
TRPA1 O75762 1/20 0.38
MAPT P10636 6/20 0.36
NLRP3 Q96P20 2/20 0.35
TTR P02766 1/20 0.35
DPP4 P27487 1/20 0.35

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
SCHEMBL345936 0.86 HCAR2 (0.56) LMNAMAPK1HTTHCAR2MGAM
SCHEMBL11792235 0.86 HCAR2 (0.56) LMNAMAPK1HTTHCAR2MGAM
SCHEMBL345935 0.86 HCAR2 (0.56) LMNAMAPK1HTTHCAR2MGAM
SCHEMBL28251620 0.86 HCAR2 (0.56) LMNAMAPK1HTTHCAR2MGAM
SCHEMBL10388246 0.85 LMNA (0.48) LMNAMAPK1HTTHCAR2ATM
SCHEMBL330246 0.84 HCAR2 (0.54) LMNAMAPK1HTTHCAR2MGAM
SCHEMBL8654856 0.84 HCAR2 (0.54) LMNAMAPK1HTTHCAR2MGAM
SCHEMBL38662185 0.84 HCAR2 (0.54) LMNAMAPK1HTTHCAR2MGAM
SCHEMBL7020452 0.84 HCAR2 (0.54) LMNAMAPK1HTTHCAR2MGAM
SCHEMBL329729 0.84 HCAR2 (0.54) LMNAMAPK1HTTHCAR2MGAM

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-4517308-A ABSORBERS, BINDING, SHAPING COLLO GMBH (DE) 1985-05-14 US disclosed