SCHEMBL7454061

SCHEMBL7454061

COc1cc2c(Nc3ccc(C)c(OC(C)=O)c3)ncnc2cc1OCc1nc2ccccc2n1C

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.51
MAPK14 Q16539 1/20 0.51
KDR P35968 13/20 0.51
RET P07949 1/20 0.51
KIF5B P33176 1/20 0.51
ERBB2 P04626 1/20 0.49
CLK1 P49759 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.48
MAPT P10636 1/20 0.48
LCK P06239 1/20 0.48

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
SCHEMBL7455304 0.88 KDR (0.68) EGFRMAPK14KDRRETKIF5B
Hydrochloric Acid SCHEMBL7455802 0.87 KDR (0.67) EGFRMAPK14KDRRETKIF5B
SCHEMBL1467608 0.84 EGFR (0.69) EGFRMAPK14KDRRETKIF5B
Hydrochloric Acid SCHEMBL7453718 0.83 EGFR (0.68) EGFRMAPK14KDRRETKIF5B
SCHEMBL7451118 0.83 EGFR (0.72) EGFRMAPK14KDRRETKIF5B
SCHEMBL1467795 0.81 EGFR (0.66) EGFRKDRRETKIF5BCLK1
SCHEMBL7460056 0.80 KDR (0.67) EGFRKDRRETKIF5BERBB2
SCHEMBL7451285 0.80 EGFR (0.57) EGFRMAPK14KDRRETKIF5B
SCHEMBL7452916 0.79 KDR (0.69) EGFRMAPK14KDRRETKIF5B
SCHEMBL7446874 0.78 KDR (0.56) EGFRMAPK14KDRRETKIF5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6362336-B1 ADMINISTERING A QUINAZOLINE DERIVATIVE TO A WARM-BLOODED ANIMAL FOR PRODUCING AN ANTIANGIOGENIC AND/OR VASCULAR PERMEABILITY REDUCING EFFECT ZENECA LIMITED (GB) 2002-03-26 US disclosed
US-20020032208-A1 Chemical compounds ZENECA LIMITED 2002-03-14 US disclosed
EP-0873319-B1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2001-07-25 EP disclosed
US-6258951-B1 ANTICANCER, ANTIARTHRITIC AGENTS ZENECA LIMITED (GB) 2001-07-10 US disclosed
US-6071921-A Chemical compounds ZENECA LIMITED (GB) 2000-06-06 US disclosed
US-5962458-A ANGIOGENESIS INHIBITORS, ANTICANCER AGENTS, ANTIDIABETIC AGENTS, SKIN DISORDERS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, VISION DEFECTS ZENECA LIMITED (GB) 1999-10-05 US disclosed
EP-0873319-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1998-10-28 EP disclosed
WO-1997022596-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-06-26 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-20020032208-A1 Chemical compounds FLT1, CNKSR1, KDR EGFR 48/4885MAPK14 1405/4885KDR 3/4885

“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.