SCHEMBL5555728

SCHEMBL5555728

C=CCN(C(C)=O)C(=O)CO

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL7044812 0.84 ALDH1A1 (0.41) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL11435724 0.83 ALDH1A1 (0.39) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL14433390 0.81 ALDH1A1 (0.39) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL7000677 0.81 ALDH1A1 (0.38) ALDH1A1
SCHEMBL27395301 0.80 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2
SCHEMBL17035289 0.78 ALDH1A1 (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL11688677 0.76 ALDH1A1 (0.35) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL11688669 0.76 ALDH1A1 (0.35) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL1416219 0.72 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL6160109 0.72 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778708-A1 NOVEL GLYCOPOLYMERS, USES THEREOF, AND MONOMERS USEFUL FOR PREPARATION THEREOF RHODIA CHIMIE (FR) 2007-05-02 EP disclosed
WO-2006016063-A1 NOVEL GLYCOPOLYMERS, USES THEREOF, AND MONOMERS USEFUL FOR PREPARATION THEREOF RHODIA CHIMIE (FR) 2006-02-16 WO disclosed