SCHEMBL5564595

SCHEMBL5564595

COc1ccc(Nc2ncnc3c(C)cccc23)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.67
EGFR P00533 5/20 0.62
CLK1 P49759 3/20 0.62
LCK P06239 1/20 0.61
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
KDM4E B2RXH2 3/20 0.57
MAPT P10636 3/20 0.57
ALDH1A1 P00352 2/20 0.57
HPGD P15428 2/20 0.57
LMNA P02545 1/20 0.57
MAPK1 P28482 1/20 0.57
HTT P42858 1/20 0.54
HSD17B10 Q99714 1/20 0.53
ERBB2 P04626 1/20 0.53
RET P07949 3/20 0.52
KDR P35968 3/20 0.52
KIF5B P33176 2/20 0.52
SRC P12931 1/20 0.51

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
SCHEMBL2255930 0.80 ABCG2 (1.00) ABCG2EGFRCLK1LCKMEN1
SCHEMBL5565322 0.79 AURKA (0.52) EGFRCLK1LCKMAPTHTT
SCHEMBL5564578 0.79 MAPT (0.55) EGFRLCKMAPTLMNAHTT
SCHEMBL5564423 0.79 HTT (0.56) EGFRMEN1KMT2AKDM4EMAPT
SCHEMBL5569470 0.78 EGFR (0.58) ABCG2EGFRCLK1KDM4EALDH1A1
SCHEMBL5569425 0.77 EGFR (0.72) ABCG2EGFRMAPK1ERBB2KDR
SCHEMBL5568231 0.77 EGFR (0.64) EGFRLCKMEN1KMT2AKDM4E
SCHEMBL5569113 0.77 EGFR (0.53) ABCG2EGFRMEN1KMT2AKDM4E
SCHEMBL5565137 0.77 EGFR (1.00) ABCG2EGFRCLK1LCKRET
SCHEMBL5568069 0.77 JAK2 (0.56) EGFRLCKMEN1KMT2AKDM4E

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 ABCG2 311/4885EGFR 1445/4885CLK1 550/4885

“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.