SCHEMBL4028016

SCHEMBL4028016

CC(=O)Nc1ccsc1-c1nc(C(=O)O)c(O)c(=O)n1C

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 6/20 0.58
ERCC1 P07992 1/20 0.58
ERCC4 Q92889 1/20 0.58
MAPK8 P45983 1/20 0.36
MAPK10 P53779 1/20 0.36
ERCC5 P28715 3/20 0.35
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL4030403 0.88 ERCC1 (0.56) FEN1ERCC1ERCC4
SCHEMBL4027570 0.87 ERCC1 (0.55) FEN1ERCC1ERCC4MAPK8MAPK10
SCHEMBL4026222 0.84 ERCC1 (0.49) FEN1ERCC1ERCC4MAPK8MAPK10
SCHEMBL4030887 0.83 ERCC1 (0.51) FEN1ERCC1ERCC4MAPTALDH1A1
SCHEMBL4027165 0.83 ERCC1 (0.51) FEN1ERCC1ERCC4MAPK8MAPK10
SCHEMBL4028019 0.83 FEN1 (0.39) FEN1ERCC1ERCC4MAPK8MAPK10
SCHEMBL4029253 0.83 FEN1 (0.63) FEN1ERCC1ERCC4MAPTALDH1A1
SCHEMBL4028018 0.82 ERCC1 (0.49) FEN1ERCC1ERCC4ALDH1A1
SCHEMBL4027678 0.81 FEN1 (0.62) FEN1ERCC1ERCC4MAPT
SCHEMBL6436946 0.81 FEN1 (0.62) FEN1ERCC1ERCC4ERCC5

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 6 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 claimed
US-20050130997-A1 Pyrimidinone viral polymerase inhibitors ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2005-06-16 US claimed
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 FEN1 343/4885ERCC1 3181/4885ERCC4 1663/4885

“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.