SCHEMBL6924148

SCHEMBL6924148

COC(=O)[C@H](C)N(CC(N)C(=O)OC(C)(C)C)C(=O)Cn1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TK1 P04183 6/20 0.38
TYMP P19971 2/20 0.35
TK2 O00142 2/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.33
MAPK1 P28482 1/20 0.33
HPGD P15428 1/20 0.32

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
SCHEMBL6928564 1.00 TK1 (0.38) TK1TYMPTK2KMT2AHTT
SCHEMBL6924149 0.91 TK1 (0.39) TK1TYMPTK2KMT2AHPGD
SCHEMBL6931042 0.91 TK1 (0.39) TK1TYMPTK2KMT2AHPGD
SCHEMBL5358371 0.90 TK1 (0.37) TK1TYMPTK2KMT2AMAPK1
SCHEMBL8135550 0.86 TK1 (0.37) TK1TYMPTK2KMT2AHPGD
SCHEMBL6924145 0.82 TK1 (0.37) TK1TYMPKMT2AMAPK1HPGD
SCHEMBL6928560 0.82 TK1 (0.37) TK1TYMPKMT2AMAPK1HPGD
SCHEMBL5349908 0.80 TK1 (0.39) TK1TK2KMT2AHPGD
SCHEMBL8150170 0.80 TK1 (0.41) TK1TK2KMT2AMAPK1HPGD
SCHEMBL5366400 0.80 KMT2A (0.40) TK1TYMPKMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0960121-A4 PEPTIDE NUCLEIC ACIDS HAVING ENHANCED BINDING AFFINITY, SEQUENCE SPECIFICITY AND SOLUBILITY BUCHARDT DORTE (DK) 2003-05-28 EP disclosed
EP-0960121-A1 PEPTIDE NUCLEIC ACIDS HAVING ENHANCED BINDING AFFINITY, SEQUENCE SPECIFICITY AND SOLUBILITY BUCHARDT, Dorte (DK) 1999-12-01 EP disclosed
WO-1998003542-A1 PEPTIDE NUCLEIC ACIDS HAVING ENHANCED BINDING AFFINITY, SEQUENCE SPECIFICITY AND SOLUBILITY BUCHARDT, DORTE (DK) 1998-01-29 WO disclosed