SCHEMBL5467825

SCHEMBL5467825

COc1cc2ncnc(Nc3ccc(Br)cc3)c2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 1.00
KDR P35968 7/20 1.00
LCK P06239 5/20 0.80
RET P07949 2/20 0.78
GAK O14976 2/20 0.78
JAK3 P52333 2/20 0.78
FLT1 P17948 1/20 0.78
RIPK2 O43353 1/20 0.78
STK10 O94804 1/20 0.78
FLT3 P36888 1/20 0.78
AAK1 Q2M2I8 1/20 0.78
Q6ZSR9 Q6ZSR9 1/20 0.78
SLK Q9H2G2 1/20 0.78
IRAK4 Q9NWZ3 1/20 0.78
RPS6KA6 Q9UK32 1/20 0.78
ALK Q9UM73 1/20 0.78
ABCG2 Q9UNQ0 3/20 0.77
CLK1 P49759 1/20 0.77
ERBB2 P04626 2/20 0.76
KDM4E B2RXH2 1/20 0.76

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
Hydrochloric Acid SCHEMBL5479908 0.99 EGFR (0.97) EGFRKDRLCKRETGAK
SCHEMBL31067640 0.90 KDR (0.84) EGFRKDRRETGAKJAK3
SCHEMBL28646400 0.89 KDR (0.80) EGFRKDRLCKRETGAK
SCHEMBL5472599 0.89 EGFR (1.00) EGFRKDRLCKRETGAK
SCHEMBL5473778 0.89 EGFR (0.80) EGFRKDRLCKRETGAK
SCHEMBL3533221 0.89 EGFR (0.80) EGFRKDRLCKRETGAK
SCHEMBL5570070 0.88 EGFR (0.85) EGFRKDRLCKRETGAK
SCHEMBL1387182 0.87 EGFR (0.94) EGFRKDRLCKRETGAK
SCHEMBL5477771 0.87 KDR (1.00) EGFRKDRLCKRETGAK
SCHEMBL5473780 0.87 EGFR (0.78) EGFRKDRLCKRETGAK

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 20 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
CN-102391168-B Symmetrical bifunctional coupling agent and coupling molecule developer thereof FIRST AFFILIATED HOSPITAL SUN YAT SEN UNIV 2013-11-27 CN disclosed
US-8513267-B2 4-anilinoquinazoline derivatives with adenosine-kinase inhibitor properties UNIVERSIDADE ESTADUAL DE CAMPINAS-UNICAMP (BR) 2013-08-20 US disclosed
EP-1737832-B1 4-ANILINOQUINAZOLINE DERIVATIVES WITH ADENOSINE-KINASE INHIBITORY PROPERTIES UNICAMP (BR) 2011-12-14 EP disclosed
US-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections GPC BIOTECH AG (DE) 2007-05-31 US disclosed
US-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections GPC BIOTECH AG (DE) 2007-05-31 US disclosed
US-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections GPC BIOTECH AG (DE) 2007-05-31 US disclosed
US-20070060600-A1 4-Anilinequinazolines with adenosine-kiase inhibitor properties UNIVERSIDADE ESTADUAL DE CAMPINAS-UNICAMP (BR) 2007-03-15 US disclosed
EP-1673346-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC Biotech AG (DE) 2006-06-28 EP disclosed
US-7038049-B2 Haloanilino quinazolines and therapeutic use thereof PARKER HUGHES INSTITUTE (US) 2006-05-02 US disclosed
WO-2005040125-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC BIOTECH AG (DE) 2005-05-06 WO disclosed
US-20050075353-A1 Quinazolines and therapeutic use thereof PARKER HUGHES INSTITUTE (US) 2005-04-07 US disclosed
US-6638939-B2 Anticancer agents PARKER HUGHES INSTITUTE 2003-10-28 US disclosed
US-20020137757-A1 Quinazolines and therapeutic use thereof PARKER HUGHES INSTITUTE (US) 2002-09-26 US disclosed
US-20020111360-A1 Quinazoline formulations and therapeutic use thereof PARKER HUGHES INSTITUTE 2002-08-15 US disclosed
US-6358962-B2 ANTIALLERGENS; ANTITUMOR AGENTS; ANTICANCER AGENTS PARKER HUGHES INSTITUTE 2002-03-19 US disclosed
US-20010016588-A1 Quinazolines and therapeutic use thereof HUGHES INSTITUTE (US) 2001-08-23 US disclosed
US-6258820-B1 ANTITUMOR AGENTS PARKER HUGHES INSTITUTE 2001-07-10 US 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 (6 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-20050075353-A1 Quinazolines and therapeutic use thereof HRH2, HRH4, HNMT EGFR 1931/4885KDR 3004/4885LCK 181/4885
US-20020111360-A1 Quinazoline formulations and therapeutic use thereof CMA1, MAST3, MAST1 EGFR 3336/4885KDR 2810/4885LCK 525/4885
US-20070060600-A1 4-Anilinequinazolines with adenosine-kiase inhibitor properties ADK, AK1, ADORA3 EGFR 3142/4885KDR 1289/4885LCK 860/4885
US-20020137757-A1 Quinazolines and therapeutic use thereof HRH2, HRH4, HNMT EGFR 1931/4885KDR 3004/4885LCK 181/4885
US-20010016588-A1 Quinazolines and therapeutic use thereof HRH2, HRH4, HNMT EGFR 1931/4885KDR 3004/4885LCK 181/4885
US-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections IRF3, PML, TPMT EGFR 1445/4885KDR 2712/4885LCK 10/4885

“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.