SCHEMBL5356576

SCHEMBL5356576

O=[N+]([O-])c1ccc(-c2nc3c(Nc4ccc(Cl)cc4)ncnc3o2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.56
CETP P11597 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
PIK3CA P42336 3/20 0.42
PIK3CB P42338 3/20 0.42
PIK3CG P48736 3/20 0.42
TTBK1 Q5TCY1 2/20 0.42
TTBK2 Q6IQ55 2/20 0.42
EGFR P00533 2/20 0.41
HSPD1 P10809 1/20 0.41
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN5 P54829 1/20 0.41
HSPE1 P61604 1/20 0.41
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
PTGS2 P35354 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
SCHEMBL5348949 0.89 ALK (0.52) GSK3BTTBK1TTBK2EGFRHSPD1
SCHEMBL14355886 0.89 GSK3B (0.54) GSK3BEGFRABCG2
SCHEMBL5358394 0.88 EGFR (0.56) GSK3BCETPTTBK1TTBK2EGFR
SCHEMBL5350269 0.84 TTBK1 (0.45) GSK3BADORA3TTBK1TTBK2EGFR
SCHEMBL5350239 0.81 MEN1 (0.52) GSK3BTTBK1TTBK2EGFRABCG2
SCHEMBL5349645 0.80 MMP2 (0.47) GSK3BCETPADORA3HSPD1PTPN2
SCHEMBL5351369 0.79 EGFR (0.59) GSK3BEGFRABCG2
SCHEMBL652053 0.72 POLB (0.53) EGFRABCG2
SCHEMBL5352136 0.72 TTBK1 (0.45) GSK3BTTBK1TTBK2ABCG2
SCHEMBL5350251 0.72 GSK3B (0.53) GSK3BEGFRABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7294633-B2 Oxazolo-and furopyrimidines and their use in medicaments against tumors NOVARTIS AG (CH) 2007-11-13 US claimed
EP-1390371-B1 OXAZOLO-AND FUROPYRIMIDINES AND THEIR USE IN MEDICAMENTS AGAINST TUMORS NOVARTIS AG (CH) 2006-03-08 EP claimed
US-20040152892-A1 Oxazolo-and furopyrimidines and their use in medicaments against tumors NOVARTIS AG (CH) 2004-08-05 US claimed
EP-1390371-A1 OXAZOLO-AND FUROPYRIMIDINES AND THEIR USE IN MEDICAMENTS AGAINST TUMORS Novartis AG (CH) 2004-02-25 EP claimed
WO-2002092603-A1 OXAZOLO-AND FUROPYRIMIDINES AND THEIR USE IN MEDICAMENTS AGAINST TUMORS NOVARTIS AG (CH) 2002-11-21 WO claimed
US-7294633-B2 Oxazolo-and furopyrimidines and their use in medicaments against tumors NOVARTIS AG (CH) 2007-11-13 US disclosed
EP-1390371-B1 OXAZOLO-AND FUROPYRIMIDINES AND THEIR USE IN MEDICAMENTS AGAINST TUMORS NOVARTIS AG (CH) 2006-03-08 EP disclosed
US-20040152892-A1 Oxazolo-and furopyrimidines and their use in medicaments against tumors NOVARTIS AG (CH) 2004-08-05 US 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-20040152892-A1 Oxazolo-and furopyrimidines and their use in medicaments against tumors DPYD, COXFA4L2, MSH2 GSK3B 1026/4885CETP 3113/4885ADORA3 1924/4885

“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.