SCHEMBL4028007

SCHEMBL4028007

O=C(O)c1ccc(Cn2c(-c3cccs3)cc(C(=O)O)c(O)c2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.47
FEN1 P39748 7/20 0.43
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
POLB P06746 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 1/20 0.42
PPARG P37231 1/20 0.42
NCOA2 Q15596 1/20 0.42
NCOA1 Q15788 1/20 0.42
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ERCC5 P28715 5/20 0.41
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
THRB P10828 1/20 0.40
NR4A1 P22736 1/20 0.40

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
SCHEMBL4028012 0.85 ALDH1A1 (0.39) FEN1ALDH1A1KDM4EPOLBTDP1
SCHEMBL1034639 0.69 ALDH1A1 (0.49) ALDH1A1KDM4EPOLBTDP1HPGD
SCHEMBL4028669 0.68 FEN1 (0.65) FEN1ALDH1A1KDM4EPOLBMAPT
SCHEMBL17211731 0.64 ALDH1A1 (0.64) ALDH1A1KDM4EPOLBTDP1MAPT
SCHEMBL420705 0.63 KDM4E (0.55) PTPN1ALDH1A1KDM4EPOLBMAPT
SCHEMBL2482769 0.63 SRPK1 (0.51) PTPN1KDM4EPPARGMEN1KMT2A
SCHEMBL10338606 0.63 SRPK1 (0.51) PTPN1KDM4EPPARGMEN1KMT2A
SCHEMBL4028670 0.63 ALDH1A1 (0.50) FEN1ALDH1A1KDM4EPOLBMAPT
SCHEMBL10527673 0.63 CYP2C9 (0.51) ALDH1A1POLBHPGDHDAC1HDAC6
SCHEMBL8937581 0.62 KDM4E (0.44) PTPN1ALDH1A1KDM4EPOLBTDP1

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 PTPN1 2030/4885FEN1 343/4885ALDH1A1 255/4885

“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.