SCHEMBL5361906

SCHEMBL5361906

Nc1cccc(Nc2ncnc3oc(-c4ccc([N+](=O)[O-])cc4)cc23)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.49
ABCG2 Q9UNQ0 3/20 0.48
AHR P35869 1/20 0.45
TTBK1 Q5TCY1 2/20 0.43
TTBK2 Q6IQ55 2/20 0.43
KDR P35968 1/20 0.43
GSK3B P49841 1/20 0.43
RAF1 P04049 1/20 0.42
BRAF P15056 1/20 0.42

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
SCHEMBL5359718 0.89 EGFR (0.62) EGFRABCG2TTBK1TTBK2KDR
SCHEMBL5355580 0.87 AHR (0.52) EGFRAHRKDRGSK3BRAF1
SCHEMBL5362131 0.81 ALK (0.45) EGFRABCG2TTBK1TTBK2KDR
SCHEMBL14355895 0.80 GSK3B (0.47) EGFRKDRGSK3B
SCHEMBL5358390 0.79 ABCG2 (0.53) ABCG2KDRGSK3BRAF1BRAF
SCHEMBL5355467 0.77 EGFR (0.58) EGFRTTBK1TTBK2KDRGSK3B
SCHEMBL18349251 0.77 EGFR (0.77) EGFRABCG2AHRRAF1BRAF
SCHEMBL5354535 0.75 KDR (0.46) EGFRKDRGSK3BRAF1BRAF
SCHEMBL5354432 0.74 MEN1 (0.45) KDRGSK3B
SCHEMBL5356238 0.74 GABRP (0.48) EGFRKDRGSK3B

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 5 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

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 EGFR 1321/4885ABCG2 518/4885AHR 1502/4885

“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.