SCHEMBL4750877

SCHEMBL4750877

CC(C)(C)OC(=O)C(CCC(=O)O)NC(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 8/20 0.38
NAALAD2 Q9Y3Q0 2/20 0.38
RIMKLA Q8IXN7 1/20 0.38
GGH Q92820 1/20 0.37
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
GABRA4 P48169 2/20 0.33
GABRE P78334 2/20 0.33
GABRA6 Q16445 2/20 0.33

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
SCHEMBL22316563 0.87 CTSK (0.38) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL27400896 0.85 FOLH1 (0.39) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL13863589 0.85 FOLH1 (0.39) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL5172322 0.83 ANPEP (0.42) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL12267040 0.83 ANPEP (0.42) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL22316568 0.83 ANPEP (0.42) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL12626915 0.81 FOLH1 (0.43) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL4363123 0.81 FOLH1 (0.43) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL6948884 0.80 FOLH1 (0.42) FOLH1NAALAD2RIMKLAGGH
SCHEMBL22271661 0.80 FOLH1 (0.38) FOLH1NAALAD2RIMKLAGGHMEN1

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
WO-2008145609-A1 METHOD OF MAKING COVALENT CONJUGATES WITH HIS-TAGGED PROTEINS NOVARTIS AG (CH) 2008-12-04 WO disclosed