SCHEMBL5570060

SCHEMBL5570060

COc1cc2nc(C)nc(Nc3cccc(Cl)c3)c2cc1OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 3/20 0.74
EGFR P00533 11/20 0.68
KDM4E B2RXH2 2/20 0.68
MAPT P10636 2/20 0.68
MAPK1 P28482 2/20 0.68
MEN1 O00255 1/20 0.68
GMNN O75496 1/20 0.68
ALDH1A1 P00352 1/20 0.68
ABL1 P00519 1/20 0.68
LMNA P02545 1/20 0.68
RAF1 P04049 1/20 0.68
TP53 P04637 1/20 0.68
CYP1A2 P05177 1/20 0.68
GLA P06280 1/20 0.68
CYP3A4 P08684 1/20 0.68
CYP2D6 P10635 1/20 0.68
SRC P12931 1/20 0.68
HPGD P15428 1/20 0.68
ALOX15 P16050 1/20 0.68
NFKB1 P19838 1/20 0.68

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
SCHEMBL6218711 0.89 EGFR (0.70) FBP1EGFRKDM4EMAPTMAPK1
SCHEMBL6662850 0.88 ABCG2 (0.74) FBP1EGFRKDM4EMAPTMAPK1
SCHEMBL12069892 0.85 FBP1 (0.74) FBP1EGFRLCKABCG2KDR
SCHEMBL5564585 0.85 FBP1 (1.00) FBP1EGFRKDM4EMAPTMAPK1
Hydrochloric Acid SCHEMBL8809754 0.81 FBP1 (0.68) FBP1EGFRRAF1SRCLCK
Tyrphostin Ag-1478 SCHEMBL93838 0.81 EGFR (1.00) FBP1EGFRKDM4EMAPTMAPK1
Tyrphostin Ag-1478 SCHEMBL31079458 0.81 EGFR (1.00) FBP1EGFRKDM4EMAPTMAPK1
Tyrphostin Ag-1478 SCHEMBL29483198 0.81 EGFR (1.00) FBP1EGFRKDM4EMAPTMAPK1
Tyrphostin Ag-1478 SCHEMBL29350062 0.81 EGFR (1.00) FBP1EGFRKDM4EMAPTMAPK1
SCHEMBL5568019 0.80 ABCG2 (0.80) FBP1EGFRRAF1ABCG2ERBB2

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 FBP1 1906/4885EGFR 1445/4885KDM4E 1004/4885

“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.