SCHEMBL3192144

SCHEMBL3192144

COc1cc2c(Nc3cccc4c3OOC4)ncnc2cc1OCC(O)CN(C)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RET P07949 11/20 0.48
KIF5B P33176 6/20 0.47
KDR P35968 6/20 0.47
SRC P12931 3/20 0.47
EGFR P00533 5/20 0.44
FLT1 P17948 1/20 0.44

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
SCHEMBL3192166 0.86 KDR (0.60) RETKIF5BKDRSRCEGFR
SCHEMBL3669671 0.82 KDR (0.58) RETKIF5BKDRSRCEGFR
SCHEMBL3674417 0.80 KDR (0.60) RETKIF5BKDREGFR
SCHEMBL3669676 0.79 EGFR (0.45) RETKIF5BKDRSRCEGFR
SCHEMBL5757222 0.79 KDR (0.69) RETKIF5BKDRSRCEGFR
SCHEMBL6055729 0.78 KDR (0.60) RETKIF5BKDRSRCEGFR
SCHEMBL5451080 0.78 FLT1 (0.69) KDREGFRFLT1
Hydrochloric Acid SCHEMBL5453272 0.78 KDR (0.68) RETKIF5BKDRSRCEGFR
Hydrochloric Acid SCHEMBL5451358 0.78 FLT1 (0.68) KDREGFRFLT1
Hydrochloric Acid SCHEMBL7582556 0.77 EGFR (0.66) RETKIF5BKDRSRCEGFR

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1453492-B1 USE OF QUINAZOLINES TO TREAT T-CELL MEDIATED DISEASES ASTRAZENECA AB (SE) 2007-01-24 EP claimed
US-7157467-B2 Administering compound such as 6-methoxy-4-(2,3-methylenedioxyanilino)-7-(3-morpholinopropoxy)quinazoline for therapy of an autoimmune disease or medical condition selected from transplant rejection and rheumatoid arthritis ASTRAZENECA AB (SE) 2007-01-02 US claimed
US-20050014773-A1 Therapeutic use ASTRAZENACA AB (SE) 2005-01-20 US claimed
US-20040034046-A1 Quinazoline derivatives ASTRAZENECA AB (SE) 2004-02-19 US claimed
US-20100029673-A1 THERAPEUTIC AGENTS COMPRISING AN ANTI-ANGIOGENIC AGENT IN COMBINATION WITH AN SRC-INHIBITOR AND THEIR THERAPEUTIC USE ASTRAZENECA AB (SE) 2010-02-04 US disclosed
US-7157467-B2 Administering compound such as 6-methoxy-4-(2,3-methylenedioxyanilino)-7-(3-morpholinopropoxy)quinazoline for therapy of an autoimmune disease or medical condition selected from transplant rejection and rheumatoid arthritis ASTRAZENECA AB (SE) 2007-01-02 US disclosed
US-20060142297-A1 Combination product of inhibitor of the src family of non-recetpor tyrosine kinases and gemcitabine ASTRAZENECA AB (SE) 2006-06-29 US disclosed
US-20040034046-A1 Quinazoline derivatives ASTRAZENECA AB (SE) 2004-02-19 US disclosed
EP-1313727-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2003-05-28 EP disclosed
WO-2002016352-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-02-28 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 (4 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-20060142297-A1 Combination product of inhibitor of the src family of non-recetpor tyrosine kinases and gemcitabine SRC, PTPN4, PTPN1 RET 40/4885KIF5B 2305/4885KDR 825/4885
US-20100029673-A1 THERAPEUTIC AGENTS COMPRISING AN ANTI-ANGIOGENIC AGENT IN COMBINATION WITH AN SRC-INHIBITOR AND THEIR THERAPEUTIC USE SRC, CHUK, CTTN RET 209/4885KIF5B 1345/4885KDR 10/4885
US-20050014773-A1 Therapeutic use CD4, HLA-DRB1, CD74 RET 2808/4885KIF5B 1271/4885KDR 2580/4885
US-20040034046-A1 Quinazoline derivatives NQO2, NRAS, TOP1 RET 2198/4885KIF5B 2396/4885KDR 1995/4885

“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.