SCHEMBL6703360

SCHEMBL6703360

Cc1cn(OC=O)c(=O)[nH]c1=O

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.45
▸ HPGD P15428 1/20 0.44
▸ TK1 P04183 6/20 0.41
▸ TYMP P19971 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL3025206 0.78 MAPK1 (0.46) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL19995056 0.76 MAPK1 (0.44) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL2635616 0.74 MAPK1 (0.42) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL28505162 0.74 MAPK1 (0.42) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL8910349 0.73 MAPK1 (0.41) MAPK1HPGDTK1TYMP
SCHEMBL4342113 0.73 TYMP (0.49) MAPK1HPGDTK1TYMP
SCHEMBL28402505 0.73 TK1 (0.39) MAPK1HPGDTK1TYMP
SCHEMBL1092921 0.72 MAPK1 (0.43) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL6714052 0.72 TK1 (0.57) MAPK1HPGDTK1TYMP
SCHEMBL6911384 0.72 TYMP (0.44) MAPK1HPGDTK1TYMP

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
US-20040116453-A1 Synthesis and methods of use pyrimidine analogues and derivatives SPECTRUM PHARMACEUTICALS, INC. 2004-06-17 — — US disclosed
US-20030055249-A1 Synthesis and methods of use of pyrimidine analogues and derivatives NEOTHERAPEUTICS, INC. 2003-03-20 — — US disclosed
WO-2003007963-A1 PYRIMIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES NEOTHERAPEUTICS, INC. (US) 2003-01-30 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030055249-A1 Synthesis and methods of use of pyrimidine analogues and derivatives ATIC, SLC29A1, ABCG2 MAPK1 1553/4885HPGD 263/4885TK1 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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