SCHEMBL21473614

SCHEMBL21473614

COc1cc2ncnc(Nc3ccc(NC(=O)c4ccccc4)cc3F)c2cc1OC

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.79
EGFR P00533 6/20 0.79
AURKB Q96GD4 6/20 0.76
AURKA O14965 2/20 0.76
KDR P35968 5/20 0.67
IRAK4 Q9NWZ3 1/20 0.67
MET P08581 1/20 0.66
FLT1 P17948 1/20 0.64

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
SCHEMBL21473619 0.92 MAPK14 (0.81) MAPK14EGFRAURKBAURKAKDR
Anilinoquinazoline1 SCHEMBL1066538 0.87 AURKB (1.00) MAPK14EGFRAURKBAURKAKDR
Anilinoquinazoline1 SCHEMBL30195580 0.87 AURKB (1.00) MAPK14EGFRAURKBAURKAKDR
SCHEMBL21473615 0.87 KDR (0.72) MAPK14EGFRAURKBKDRIRAK4
SCHEMBL6794349 0.86 MAPK14 (0.81) MAPK14EGFRAURKBAURKAKDR
Anilinoquinazoline1 SCHEMBL3968007 0.86 AURKB (0.98) MAPK14EGFRAURKBAURKAKDR
SCHEMBL6785711 0.85 MAPK14 (1.00) MAPK14EGFRAURKBAURKAKDR
Hydrochloric Acid SCHEMBL6782357 0.84 MAPK14 (0.98) MAPK14EGFRAURKBAURKAKDR
SCHEMBL8933899 0.84 AURKB (0.94) MAPK14EGFRAURKBAURKAKDR
Hydrochloric Acid SCHEMBL8807597 0.83 AURKB (0.92) MAPK14EGFRAURKBAURKAKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210155604-A1 QUINAZOLINE COMPOUND SERVING AS EGFR TRIPLE MUTATION INHIBITOR AND APPLICATIONS THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2021-05-27 US disclosed
EP-3778586-A1 QUINAZOLINE COMPOUND SERVING AS EGFR TRIPLE MUTATION INHIBITOR AND APPLICATIONS THEREOF East China University of Science and Technology (CN) 2021-02-17 EP disclosed
WO-2019196938-A1 QUINAZOLINE COMPOUND SERVING AS EGFR TRIPLE MUTATION INHIBITOR AND APPLICATIONS THEREOF 华东理工大学 2019-10-17 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-20210155604-A1 QUINAZOLINE COMPOUND SERVING AS EGFR TRIPLE MUTATION INHIBITOR AND APPLICATIONS THEREOF EGFR, ERBB2, ERBB4 MAPK14 323/4885EGFR 1/4885AURKB 2241/4885

“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.