SCHEMBL5564600

SCHEMBL5564600

Cc1cccc2c(Nc3cc(CF)cc(CF)c3)ncnc12

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.43
AURKA O14965 9/20 0.42
AURKB Q96GD4 4/20 0.42
RPS6KB1 P23443 10/20 0.42
HTT P42858 1/20 0.41
HIF1A Q16665 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL5569470 0.79 EGFR (0.58) EGFRAURKBHTTHIF1AABCG2
SCHEMBL5570053 0.78 HPGD (0.52) EGFRHTTABCG2ALDH1A1MAPT
SCHEMBL5569425 0.76 EGFR (0.72) EGFRAURKAAURKBRPS6KB1ABCG2
SCHEMBL5568231 0.76 EGFR (0.64) EGFRHTTHIF1AALDH1A1MAPT
SCHEMBL5564908 0.75 RET (0.59) EGFRAURKAAURKBRPS6KB1HTT
SCHEMBL5569346 0.75 CCNT1 (0.50) EGFRAURKAAURKBRPS6KB1HTT
SCHEMBL5568069 0.75 JAK2 (0.56) EGFRAURKARPS6KB1HTTALDH1A1
SCHEMBL5569113 0.75 EGFR (0.53) EGFRAURKARPS6KB1ABCG2ALDH1A1
SCHEMBL5569038 0.75 TRPV1 (0.57) EGFRAURKAAURKBRPS6KB1HTT
SCHEMBL5568127 0.75 HTT (0.64) EGFRHTTHIF1AALDH1A1MAPT

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 1445/4885AURKA 151/4885AURKB 287/4885

“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.