SCHEMBL5568874

SCHEMBL5568874

Cc1ccc2ncnc(Nc3ccc(F)cc3)c2c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.74
MAPK1 P28482 3/20 0.74
KDM4E B2RXH2 2/20 0.74
NCOA1 Q15788 1/20 0.71
NCOA3 Q9Y6Q9 1/20 0.71
LMNA P02545 5/20 0.70
MAPT P10636 3/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
EGFR P00533 5/20 0.63
CYP1A2 P05177 4/20 0.61
CYP3A4 P08684 4/20 0.61
CYP2D6 P10635 4/20 0.61
CYP2C19 P33261 4/20 0.61
USP2 O75604 3/20 0.61
CLK4 Q9HAZ1 3/20 0.61
HIF1A Q16665 3/20 0.61
TP53 P04637 1/20 0.61
ALDH1A1 P00352 2/20 0.60
HPGD P15428 2/20 0.60
MEN1 O00255 2/20 0.60

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
SCHEMBL27878333 0.88 USP2 (0.65) LMNAMAPTEGFRCYP1A2CYP3A4
SCHEMBL5564480 0.87 MAPK1 (0.76) HTTMAPK1KDM4ENCOA1NCOA3
SCHEMBL5569927 0.85 KDM4E (0.74) HTTMAPK1KDM4ENCOA1NCOA3
SCHEMBL5570037 0.85 HTT (0.74) HTTMAPK1KDM4ENCOA1NCOA3
SCHEMBL2101381 0.85 HTT (1.00) HTTMAPK1KDM4ENCOA1NCOA3
SCHEMBL5565226 0.85 HTT (0.72) HTTMAPK1KDM4ELMNAMAPT
SCHEMBL5564605 0.85 MAPK1 (0.68) HTTMAPK1KDM4ENCOA1NCOA3
SCHEMBL5564769 0.85 HTT (0.78) HTTMAPK1KDM4ENCOA1NCOA3
SCHEMBL27923391 0.84 EGFR (0.73) LMNAEGFRCYP1A2CYP3A4CYP2D6
SCHEMBL5570076 0.83 HTT (0.70) HTTMAPK1KDM4ENCOA1NCOA3

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 HTT 2700/4885MAPK1 1019/4885KDM4E 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.