SCHEMBL4025328

SCHEMBL4025328

CCOc1c(C(=O)O)nc(O)n(C)c1=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.34
PTGS1 P23219 1/20 0.34
ERCC1 P07992 1/20 0.33
FEN1 P39748 1/20 0.33
ERCC4 Q92889 1/20 0.33
MAPT P10636 5/20 0.32
PKM P14618 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
ALDH1A1 P00352 1/20 0.32
AOC3 Q16853 2/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
MAPK10 P53779 1/20 0.31
THRB P10828 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA2B P29275 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL4026168 0.85 KDM5B (0.42) MAPTKDM4EHPGDALDH1A1ADORA2A
SCHEMBL22032779 0.82 TP53 (0.38) TP53ERCC1FEN1ERCC4MAPT
SCHEMBL30710400 0.79 TP53 (0.31) TP53PTGS1
SCHEMBL12225690 0.75 PKM (0.38) TP53MAPTPKMKDM4EHPGD
SCHEMBL22927770 0.73 NR3C1 (0.41) TP53PTGS1MAPTALDH1A1LMNA
SCHEMBL22032648 0.73 MAPT (0.40) MAPTKDM4EHPGDALDH1A1MAPK1
SCHEMBL22927731 0.72 MAPK1 (0.43) TP53MAPTKDM4EALDH1A1LMNA
SCHEMBL2507511 0.72 MAOA (0.48) PKMKDM4EHPGDALDH1A1LMNA
SCHEMBL13367228 0.71 MAPT (0.39) TP53MAPTPKMKDM4EHPGD
SCHEMBL22927676 0.70 MAOB (0.51) TP53PTGS1MAPTHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1470113-B1 PYRIMIDINONE VIRAL POLYMERASE INHIBITORS ANGELETTI P IST RICHERCHE BIO (IT) 2009-01-07 EP disclosed
US-20050130997-A1 Pyrimidinone viral polymerase inhibitors ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2005-06-16 US disclosed
EP-1470113-A1 PYRIMIDINONE VIRAL POLYMERASE INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2004-10-27 EP disclosed
WO-2003062211-A1 PYRIMIDINONE VIRAL POLYMERASE INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2003-07-31 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-20050130997-A1 Pyrimidinone viral polymerase inhibitors POLR2A, POLR1E, POLR2E TP53 1561/4885PTGS1 1743/4885ERCC1 3181/4885

“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.