SCHEMBL5569425

SCHEMBL5569425

Cc1cccc2c(Nc3cccc(Br)c3)ncnc12

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 15/20 0.72
ABCG2 Q9UNQ0 1/20 0.64
AURKA O14965 2/20 0.64
RPS6KB1 P23443 1/20 0.64
AURKB Q96GD4 1/20 0.58
INCENP Q9NQS7 1/20 0.58
EPHB2 P29323 1/20 0.57
ERBB2 P04626 1/20 0.57
KDR P35968 1/20 0.57
MAPK1 P28482 1/20 0.56
FBP1 P09467 1/20 0.56

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
SCHEMBL5569113 0.86 EGFR (0.53) EGFRABCG2AURKARPS6KB1EPHB2
SCHEMBL5569470 0.84 EGFR (0.58) EGFRABCG2AURKBERBB2KDR
SCHEMBL5568231 0.83 EGFR (0.64) EGFRERBB2MAPK1FBP1
SCHEMBL15070939 0.81 EGFR (0.71) EGFRABCG2EPHB2ERBB2KDR
SCHEMBL5564908 0.80 RET (0.59) EGFRABCG2AURKARPS6KB1AURKB
SCHEMBL5565322 0.80 AURKA (0.52) EGFRAURKARPS6KB1ERBB2KDR
SCHEMBL5564578 0.80 MAPT (0.55) EGFRAURKARPS6KB1ERBB2
SCHEMBL2992623 0.78 EGFR (1.00) EGFRABCG2AURKBEPHB2ERBB2
SCHEMBL663875 0.78 AURKA (1.00) EGFRABCG2AURKARPS6KB1AURKB
SCHEMBL5564595 0.77 ABCG2 (0.67) EGFRABCG2ERBB2KDRMAPK1

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
US-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections GPC BIOTECH AG (DE) 2007-05-31 US claimed
EP-1673346-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC Biotech AG (DE) 2006-06-28 EP claimed
WO-2005040125-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC BIOTECH AG (DE) 2005-05-06 WO claimed
US-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections GPC BIOTECH AG (DE) 2007-05-31 US disclosed
EP-1673346-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC Biotech AG (DE) 2006-06-28 EP disclosed
WO-2005040125-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC BIOTECH AG (DE) 2005-05-06 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-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections IRF3, PML, TPMT EGFR 1445/4885ABCG2 311/4885AURKA 151/4885

“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.