SCHEMBL9328006

SCHEMBL9328006

Cc1cn(CC(=O)N(C(C)NC(=O)OC(C)(C)C)C(C)C(=O)O)c(=O)[nH]c1=O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TK1 P04183 7/20 0.37
TYMP P19971 2/20 0.36
HPGD P15428 1/20 0.36
TK2 O00142 3/20 0.35

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
SCHEMBL2153170 1.00 TK1 (0.37) TK1TYMPHPGDTK2
SCHEMBL2685934 1.00 TK1 (0.37) TK1TYMPHPGDTK2
SCHEMBL2153594 0.91 TK1 (0.39) TK1TYMPHPGD
SCHEMBL2161843 0.91 TK1 (0.39) TK1TYMPHPGD
SCHEMBL8642049 0.82 TK1 (0.39) TK1TYMPHPGDTK2
SCHEMBL6931032 0.80 TK1 (0.38) TK1TYMPHPGDTK2
SCHEMBL6513732 0.80 TK1 (0.38) TK1TYMPHPGDTK2
SCHEMBL6924139 0.80 SLC9A1 (0.40)
SCHEMBL6931025 0.80 SLC9A1 (0.40)
SCHEMBL2153131 0.80 TK1 (0.37) TK1TYMP

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
EP-0586474-A1 PEPTIDE NUCLEIC ACIDS BUCHARDT, Ole (DK) 1994-03-16 EP disclosed