SCHEMBL4027671

SCHEMBL4027671

Cn1c(-c2sccc2NC(=O)CCc2ccccc2Cl)nc(C(=O)O)c(O)c1=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.47
FEN1 P39748 1/20 0.47
ERCC4 Q92889 1/20 0.47
MAPK10 P53779 7/20 0.41
MAPK8 P45983 6/20 0.41
THRB P10828 1/20 0.40
TNKS O95271 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
CYP2C8 P10632 2/20 0.37
CYP2C9 P11712 2/20 0.37
HCAR2 Q8TDS4 2/20 0.37
P2RX7 Q99572 1/20 0.37
RXFP1 Q9HBX9 1/20 0.36
MAPK9 P45984 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36

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
SCHEMBL4027676 0.87 MAPK8 (0.40) MAPK10MAPK8THRBTNKSTNKS2
SCHEMBL4029613 0.86 ERCC1 (0.47) ERCC1FEN1ERCC4MAPK10MAPK8
SCHEMBL4028367 0.86 ERCC1 (0.47) ERCC1FEN1ERCC4MAPK10MAPK8
SCHEMBL4029947 0.81 ERCC1 (0.47) ERCC1FEN1ERCC4P2RX7
SCHEMBL4028016 0.80 FEN1 (0.58) ERCC1FEN1ERCC4MAPK10MAPK8
SCHEMBL4030403 0.79 ERCC1 (0.56) ERCC1FEN1ERCC4CYP2C9NPC1
SCHEMBL4027126 0.79 FEN1 (0.47) ERCC1FEN1ERCC4THRBP2RX7
SCHEMBL4026809 0.79 FEN1 (0.47) ERCC1FEN1ERCC4THRBP2RX7
SCHEMBL4027570 0.78 ERCC1 (0.55) ERCC1FEN1ERCC4MAPK10MAPK8
SCHEMBL4028503 0.78 ERCC1 (0.46) ERCC1FEN1ERCC4MAPK10MAPK8

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 ERCC1 3181/4885FEN1 343/4885ERCC4 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.