SCHEMBL10554247

SCHEMBL10554247

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
CHRM5 P08912 2/20 0.46
CHRM1 P11229 2/20 0.46
CHRM3 P20309 2/20 0.46
PGR P06401 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
HTR1A P08908 1/20 0.46
CHRNB2 P17787 1/20 0.46
TBXA2R P21731 1/20 0.46
CHRNB4 P30926 1/20 0.46
CHRNA3 P32297 1/20 0.46
CHRNA7 P36544 1/20 0.46
CHRNA4 P43681 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHRNA10 Q9GZZ6 1/20 0.46
CHRNA9 Q9UGM1 1/20 0.46
TSHR P16473 1/20 0.46
GALR3 O60755 2/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL468689 0.97
SCHEMBL11160787 0.95 ALDH1A1 (0.48) ALDH1A1CHRM5CHRM1CHRM3PGR
Methane SCHEMBL5076003 0.95 ALDH1A1 (0.48) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL10878759 0.95 ALDH1A1 (0.48) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL20490065 0.95 ALDH1A1 (0.48) ALDH1A1CHRM5CHRM1CHRM3PGR
Hydrochloric Acid SCHEMBL1373161 0.95 ALDH1A1 (0.48) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL16174472 0.95 ALDH1A1 (0.48) ALDH1A1CHRM5CHRM1CHRM3PGR
Benzene SCHEMBL28463367 0.92 ALDH1A1 (0.46) ALDH1A1CHRM5CHRM1CHRM3PGR
Propionic Acid SCHEMBL28727733 0.90 ALDH1A1 (0.50) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL28607080 0.88 CHRM5 (0.46) ALDH1A1CHRM5CHRM1CHRM3PGR

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