SCHEMBL28008104

SCHEMBL28008104

O=C(O)CCC(NOCO)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 8/20 0.53
NAALAD2 Q9Y3Q0 3/20 0.53
RIMKLA Q8IXN7 1/20 0.53
GGH Q92820 2/20 0.46
TET2 Q6N021 3/20 0.40
KDM4A O75164 2/20 0.40
KDM4C Q9H3R0 2/20 0.40
KDM2A Q9Y2K7 2/20 0.40
TET3 O43151 1/20 0.40

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
SCHEMBL28008105 1.00 FOLH1 (0.53) FOLH1NAALAD2RIMKLAGGHTET2
SCHEMBL28113681 0.82 FOLH1 (0.52) FOLH1NAALAD2RIMKLAGGH
SCHEMBL6010454 0.80 FOLH1 (0.46) FOLH1NAALAD2RIMKLAGGHTET2
SCHEMBL19678634 0.79 FOLH1 (0.48) FOLH1NAALAD2RIMKLAGGH
SCHEMBL6009547 0.79 FOLH1 (0.44) FOLH1NAALAD2RIMKLAGGHTET2
SCHEMBL28528582 0.77 FOLH1 (0.46) FOLH1NAALAD2RIMKLAGGH
SCHEMBL20548064 0.74 FOLH1 (0.52) FOLH1NAALAD2RIMKLAGGH
SCHEMBL10610612 0.74 FOLH1 (0.60) FOLH1NAALAD2GGH
SCHEMBL6343393 0.74 FOLH1 (0.60) FOLH1NAALAD2GGH
SCHEMBL2447755 0.73 FOLH1 (0.67) FOLH1NAALAD2RIMKLAGGHTET2

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
CN-101970679-B aminotransferase and oxidoreductase nucleic acids and polypeptides and methods of use CARGILL INC 2015-04-22 CN disclosed