SCHEMBL4027437

SCHEMBL4027437

Cn1c(-c2sccc2[N+](=O)[O-])nc(C(=O)O)c(O)c1=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 4/20 0.57
ERCC1 P07992 2/20 0.57
ERCC4 Q92889 2/20 0.57
LMNA P02545 2/20 0.36
RXFP1 Q9HBX9 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.32
ESR2 Q92731 1/20 0.32
TSHR P16473 3/20 0.32
CTSB P07858 1/20 0.32
CTSH P09668 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL4028581 0.89 ERCC1 (0.44) FEN1ERCC1ERCC4LMNARXFP1
SCHEMBL4031769 0.83 FEN1 (0.38) FEN1ERCC1ERCC4LMNARXFP1
SCHEMBL4029253 0.82 FEN1 (0.63) FEN1ERCC1ERCC4ESR2TDP1
SCHEMBL4027678 0.81 FEN1 (0.62) FEN1ERCC1ERCC4RXFP1TDP1
SCHEMBL6436946 0.81 FEN1 (0.62) FEN1ERCC1ERCC4
Hydrochloric Acid SCHEMBL4031283 0.80 FEN1 (0.60) FEN1ERCC1ERCC4
SCHEMBL4028016 0.78 FEN1 (0.58) FEN1ERCC1ERCC4MAPT
SCHEMBL4028108 0.76 ALDH1A1 (0.35) FEN1ERCC1ERCC4LMNARXFP1
SCHEMBL4026329 0.76 ALDH1A1 (0.35) FEN1ERCC1ERCC4LMNARXFP1
SCHEMBL4028792 0.74 ERCC1 (0.57) FEN1ERCC1ERCC4LMNAL3MBTL1

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.