Vandetanib

Vandetanib

SCHEMBL1614458

COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1.Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

EGFREPHA1EPHA10EPHA2EPHA3EPHA4EPHA5EPHA6EPHA7EPHA8EPHB1EPHB2EPHB3EPHB4EPHB6ERBB2ERBB3ERBB4FLT1FLT4KDRPTK6RETSRCTEK

The experimentally established mechanism targets of Vandetanib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR known ✓ P00533 16/20 1.00
KDR known ✓ P35968 12/20 1.00
FLT1 known ✓ P17948 11/20 1.00
FLT4 known ✓ P35916 11/20 1.00
TEK known ✓ Q02763 2/20 1.00
EPHA2 known ✓ P29317 3/20 0.98
EPHB4 known ✓ P54760 3/20 0.98
RET known ✓ P07949 2/20 0.98
EPHB6 known ✓ O15197 1/20 0.98
ERBB2 known ✓ P04626 1/20 0.98
SRC known ✓ P12931 1/20 0.98
EPHA1 known ✓ P21709 1/20 0.98
ERBB3 known ✓ P21860 1/20 0.98
EPHA3 known ✓ P29320 1/20 0.98
EPHA8 known ✓ P29322 1/20 0.98
EPHB2 known ✓ P29323 1/20 0.98
EPHA5 known ✓ P54756 1/20 0.98
EPHB1 known ✓ P54762 1/20 0.98
EPHA4 known ✓ P54764 1/20 0.98
PTK6 known ✓ Q13882 1/20 0.98

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
Vandetanib SCHEMBL28224661 0.99 EGFR (1.00) EGFRKDRFGFR1FLT1FLT4
Vandetanib SCHEMBL9044 0.99 EGFR (1.00) EGFRKDRFGFR1FLT1FLT4
Vandetanib SCHEMBL29352879 0.99 EGFR (1.00) EGFRKDRFGFR1FLT1FLT4
Vandetanib SCHEMBL4637084 0.98 EGFR (0.98) EGFRKDRFGFR1FLT1FLT4
Vandetanib SCHEMBL1783178 0.93 EGFR (0.89) EGFRKDRFGFR1FLT1FLT4
SCHEMBL4544070 0.92 EGFR (0.87) EGFRKDRFGFR1FLT1FLT4
Vandetanib SCHEMBL1614619 0.92 EGFR (0.86) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26359052 0.91 EGFR (0.85) EGFRKDRFGFR1FLT1FLT4
SCHEMBL12534441 0.91 EGFR (0.85) EGFRKDRFGFR1FLT1FLT4
SCHEMBL16085055 0.91 EGFR (0.84) EGFRKDRFGFR1FLT1FLT4

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210276972-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2021-09-09 US disclosed
US-20200262811-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2020-08-20 US disclosed
US-10457664-B2 Quinazoline derivatives as VEGF inhibitors GENZYME CORPORATION (US) 2019-10-29 US disclosed
US-20190002433-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2019-01-03 US disclosed
US-20180099946-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2018-04-12 US disclosed
US-20160130249-A1 Quinazoline Derivatives as VEGF Inhibitors ASTRAZENECA AB (SE) 2016-05-12 US disclosed
US-9040548-B2 Quinazoline derivatives as VEGF inhibitors ASTRAZENECA AB (SE) 2015-05-26 US disclosed
US-20140121228-A1 Quinazoline Derivatives as VEGF Inhibitors ASTRAZENECA AB (SE) 2014-05-01 US disclosed
US-8642608-B2 Quinazoline derivatives as VEGF inhibitors ASTRAZENECA AB (SE) 2014-02-04 US disclosed
US-20120252827-A1 COMBINATION OF THERAPY COMPRISING ZD6474 AND A TAXANE WEDGE STEPHEN ROBERT (GB) 2012-10-04 US disclosed
US-20060142316-A1 Combination therapy ASTRAZENECA AB (SE) 2006-06-29 US disclosed
EP-1244647-B1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2006-06-21 EP disclosed
US-20050222183-A1 Combination of zd6474, an inhibitor of the vascular endothelial growth factor receptor, with radiotherapy in the treatment of cancer ASTRAZENECA AB (SE) 2005-10-06 US disclosed
EP-1534287-A1 COMBINATION OF ZD6474, AN INHIBITOR OF THE VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR, WITH RADIOTHERAPY IN THE TREATMENT OF CANCER Astrazeneca AB (SE) 2005-06-01 EP disclosed
US-20050043395-A1 Combination therapy comprising zd6474 and a taxane ASTRAZENECA AB (SE) 2005-02-24 US disclosed
EP-1446124-A1 COMBINATION THERAPY COMPRISING ZD6474 AND A TAXANE AstraZeneca AB (SE) 2004-08-18 EP disclosed
WO-2004014383-A1 COMBINATION OF ZD6474, AN INHIBITOR OF THE VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR, WITH RADIOTHERAPY IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2004-02-19 WO disclosed
WO-2003039551-A1 COMBINATION THERAPY COMPRISING ZD6474 AND A TAXANE ASTRAZENECA AB (SE) 2003-05-15 WO disclosed
EP-1244647-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS AstraZeneca AB (SE) 2002-10-02 EP disclosed
WO-2001032651-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2001-05-10 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 (11 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-20180099946-A1 Quinazoline Derivatives as VEGF Inhibitors FLT4, FLT1, KDR EGFR 199/4885KDR 3/4885FLT1 2/4885
US-20120252827-A1 COMBINATION OF THERAPY COMPRISING ZD6474 AND A TAXANE ZYX, VEGFA, TEK EGFR 178/4885KDR 4/4885FLT1 8/4885
US-20210276972-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR EGFR 207/4885KDR 3/4885FLT1 1/4885
US-10457664-B2 Quinazoline derivatives as VEGF inhibitors FLT1, FLT4, KDR EGFR 179/4885KDR 3/4885FLT1 1/4885
US-20160130249-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR EGFR 181/4885KDR 3/4885FLT1 1/4885
US-20140121228-A1 Quinazoline Derivatives as VEGF Inhibitors FLT4, FLT1, KDR EGFR 120/4885KDR 3/4885FLT1 2/4885
US-20200262811-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR EGFR 181/4885KDR 3/4885FLT1 1/4885
US-20060142316-A1 Combination therapy VEGFA, FLT4, FLT1 EGFR 1367/4885KDR 24/4885FLT1 3/4885
US-20190002433-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR EGFR 179/4885KDR 3/4885FLT1 1/4885
US-20050222183-A1 Combination of zd6474, an inhibitor of the vascular endothelial growth factor receptor, with radiotherapy in the treatment of cancer FLT4, KDR, TEK EGFR 7/4885KDR 2/4885FLT1 5/4885
US-20050043395-A1 Combination therapy comprising zd6474 and a taxane ZYX, VEGFA, TEK EGFR 192/4885KDR 4/4885FLT1 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.