SCHEMBL5564779

SCHEMBL5564779

Cc1ccc2ncnc(Nc3cccc(C)c3C)c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.64
MAPK1 P28482 2/20 0.62
KDM4E B2RXH2 1/20 0.62
MAPT P10636 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
LMNA P02545 1/20 0.59
TP53 P04637 2/20 0.56
EGFR P00533 3/20 0.53
ERBB2 P04626 2/20 0.53
NCOA1 Q15788 1/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
MAPKAPK2 P49137 1/20 0.53
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
KDR P35968 1/20 0.51
RET P07949 1/20 0.51
KIF5B P33176 1/20 0.51
CD38 P28907 1/20 0.51
RAF1 P04049 1/20 0.51
BRAF P15056 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
SCHEMBL21557316 0.88 CYP1A2 (0.66) HTTMAPK1KDM4EMAPTSMN1; SMN2
SCHEMBL5564640 0.86 HTT (0.62) HTTMAPK1KDM4EMAPTSMN1; SMN2
SCHEMBL5564611 0.82 KDR (0.71) HTTMAPK1KDM4EMAPTSMN1; SMN2
SCHEMBL6662890 0.82 SMN1; SMN2 (0.74) HTTMAPK1KDM4EMAPTSMN1; SMN2
SCHEMBL14026217 0.81 RET (0.61) MAPTTP53EGFRKDRRET
SCHEMBL6666099 0.81 HTT (0.68) HTTMAPK1KDM4EMAPTSMN1; SMN2
SCHEMBL13302945 0.80 MEN1 (0.52) HTTMAPTTP53EGFRKDR
SCHEMBL26449347 0.79 EGFR (0.64) HTTMAPK1KDM4EMAPTSMN1; SMN2
SCHEMBL6662659 0.78 HTT (0.67) HTTMAPK1KDM4EMAPTSMN1; SMN2
SCHEMBL8871863 0.78 EGFR (0.82) HTTMAPK1KDM4EMAPTSMN1; SMN2

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.