SCHEMBL4967307

SCHEMBL4967307

COc1cc2c(Nc3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3C)ncnc2cc1O

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.74
MAPK14 Q16539 6/20 0.69
AURKB Q96GD4 3/20 0.63
AURKA O14965 2/20 0.59
EGFR P00533 3/20 0.59
BRAF P15056 3/20 0.59
TEK Q02763 1/20 0.57
LCK P06239 1/20 0.55

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
SCHEMBL4967975 0.94 KDR (0.81) KDRMAPK14AURKBAURKAEGFR
SCHEMBL5004591 0.89 BRAF (0.69) KDRMAPK14AURKBAURKABRAF
Hydrochloric Acid SCHEMBL5004331 0.86 KDR (0.69) KDRMAPK14AURKBEGFRBRAF
SCHEMBL4969351 0.86 KDR (0.68) KDRMAPK14AURKBAURKAEGFR
SCHEMBL5007736 0.83 BRAF (0.62) KDRMAPK14BRAFTEK
SCHEMBL5000778 0.83 MAPK14 (0.73) KDRMAPK14EGFRBRAF
SCHEMBL5007815 0.82 MAPK14 (0.70) KDRMAPK14AURKBAURKAEGFR
SCHEMBL22225315 0.81 KDR (0.82) KDRMAPK14AURKBAURKAEGFR
SCHEMBL10118983 0.81 BRAF (0.88) BRAF
SCHEMBL4697842 0.79 BRAF (0.64) KDRBRAFTEK

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-20080306096-A1 Quinazoline Derivatives, Process for Their Preparation and Their Use as Anti-Cancer Agents ASTRAZENECA AB (SE) 2008-12-11 US disclosed
EP-1966159-A2 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2008-09-10 EP disclosed
WO-2007071963-A2 QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTI-CANCER AGENTS ASTRAZENECA AB (SE) 2007-06-28 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 (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-20080306096-A1 Quinazoline Derivatives, Process for Their Preparation and Their Use as Anti-Cancer Agents BRAF, RAF1, NRAS KDR 1051/4885MAPK14 104/4885AURKB 883/4885

“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.