SCHEMBL8198261

SCHEMBL8198261

CC(C)(C)OC(=O)C(CC=O)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
AAK1 Q2M2I8 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
LMNA P02545 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 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
SCHEMBL31612 0.82 GRIK1 (0.35) CTSKKMT2AMEN1GAAAAK1
SCHEMBL5082914 0.82 GRIK1 (0.35) CTSKKMT2AMEN1GAAAAK1
SCHEMBL27538085 0.79 CTSK (0.34) CTSKKMT2AMEN1GAAAAK1
SCHEMBL17871166 0.78 CTSK (0.38) CTSKKMT2AMEN1GAALMNA
SCHEMBL3745027 0.77 KMT2A (0.39) CTSKKMT2AMEN1GAAAAK1
SCHEMBL1344808 0.77 KMT2A (0.39) CTSKKMT2AMEN1GAAAAK1
SCHEMBL3745034 0.77 KMT2A (0.39) CTSKKMT2AMEN1GAAAAK1
SCHEMBL2076664 0.77 KMT2A (0.39) CTSKKMT2AMEN1GAAAAK1
SCHEMBL28710632 0.77 KMT2A (0.39) CTSKKMT2AMEN1GAAAAK1
SCHEMBL951740 0.76 CTSK (0.37) CTSKKMT2ALMNACA1CA2

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-1049660-A1 COMPOSITIONS AND METHODS FOR INHIBITING ARGINASE ACTIVITY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2000-11-08 EP disclosed
WO-1999019295-A1 COMPOSITIONS AND METHODS FOR INHIBITING ARGINASE ACTIVITY TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1999-04-22 WO disclosed