SCHEMBL10554240

SCHEMBL10554240

CC(CC(=O)O)OC=O.[Cu]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.35
GABRR1 P24046 2/20 0.34
LMNA P02545 1/20 0.34
CACNA2D1 P54289 2/20 0.33
CACNB3 P54284 1/20 0.33
CACNA1C Q13936 1/20 0.33
PGR P06401 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
CACNA2D2 Q9NY47 1/20 0.33
FOLH1 Q04609 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PGD P52209 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
MMP13 P45452 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALOX15 P16050 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
SCHEMBL13555632 0.98
SCHEMBL10878756 0.95 SLC22A6 (0.35) SLC22A6GABRR1LMNACACNA2D1CACNB3
SCHEMBL11160781 0.95 SLC22A6 (0.35) SLC22A6GABRR1LMNACACNA2D1CACNB3
SCHEMBL3773162 0.79
SCHEMBL11121195 0.77
SCHEMBL17053634 0.76 TSHR (0.39) LMNAMMP1MMP2MMP3MMP9
SCHEMBL10554238 0.76 CA2 (0.44)
SCHEMBL11160758 0.76 CA2 (0.44)
SCHEMBL10878751 0.76 CA2 (0.44)
SCHEMBL11914187 0.74 MAPT (0.33) LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4824969-A USING CATALYTIC MIXTURES OF AN OSMIUM COMPOUND, A COPPER COMPOUND AND AN N-HETEROCYCLIC COMPOUND; PROCESS CONTROL EXXON RESEARCH & ENGINEERING CO. (US) 1989-04-25 US disclosed
EP-0160148-A1 Process for the hydroxylation of olefins using molecular oxygen, an osmium containing catalyst, a copper cocatalyst, and a cycloaliphatic amine based promoter EXXON RESEARCH AND ENGINEERING COMPANY (US) 1985-11-06 EP disclosed
EP-0139498-A1 Process for the hydroxylation of olefins using molecular oxygen, an osmium containing catalyst, a copper co-catalyst, and an aromatic amine based promoter EXXON RESEARCH AND ENGINEERING COMPANY (US) 1985-05-02 EP disclosed
US-4496779-A Process for the hydroxylation of olefins using molecular oxygen, an osmium containing catalyst, a copper co-catalyst, and a cycloaliphatic amine based promoter EXXON RESEARCH & ENGINEERING CO. (US) 1985-01-29 US disclosed
US-4496778-A Process for the hydroxylation of olefins using molecular oxygen, an osmium containing catalyst, a copper Co-catalyst, and an aromatic amine based promoter EXXON RESEARCH & ENGINEERING CO. (US) 1985-01-29 US disclosed