SCHEMBL10554238

SCHEMBL10554238

CC(CC(=O)[O-])OC=O.CC(CC(=O)[O-])OC=O.[Cu+2]

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.44
CA4 P22748 2/20 0.34
SLC22A16 Q86VW1 1/20 0.34
CA1 P00915 2/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP1A2 P05177 1/20 0.32
HRH1 P35367 1/20 0.32
CPT2 P23786 1/20 0.32
CPT1A P50416 1/20 0.32
CTSL P07711 1/20 0.32
CYP2C19 P33261 1/20 0.31
RECQL P46063 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
SCHEMBL11160758 0.96 CA2 (0.44) CA2CA4SLC22A16CA1MEN1
SCHEMBL10878751 0.96 CA2 (0.44) CA2CA4SLC22A16CA1MEN1
SCHEMBL3773162 0.77
SCHEMBL13555632 0.77
SCHEMBL10554240 0.76 SLC22A6 (0.35)
SCHEMBL11160781 0.76 SLC22A6 (0.35)
SCHEMBL10878756 0.76 SLC22A6 (0.35)
SCHEMBL11914187 0.72 MAPT (0.33)
SCHEMBL6722480 0.71
SCHEMBL16995135 0.71

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