SCHEMBL5022967

SCHEMBL5022967

COc1cc2c(Nc3cnc(NC(=O)c4ccc(F)c(Cl)c4)nc3)ncnc2cc1OCC1CCN(CCOP(=O)(OCc2ccccc2)OCc2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AURKA O14965 9/20 0.65
EGFR P00533 10/20 0.55
AURKB Q96GD4 1/20 0.55
KDR P35968 3/20 0.49

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
SCHEMBL5022398 0.91 AURKA (0.70) AURKAEGFRAURKBKDR
SCHEMBL5022513 0.88 AURKA (0.72) AURKAEGFRAURKBKDR
SCHEMBL5016618 0.85 AURKA (0.69) AURKAEGFRAURKBKDR
SCHEMBL5084485 0.83 AURKA (0.67) AURKAEGFRAURKBKDR
Trifluoroacetic Acid SCHEMBL5025451 0.80 AURKA (0.62) AURKAEGFRAURKBKDR
SCHEMBL5091126 0.80 AURKA (0.68) AURKAEGFRAURKBKDR
SCHEMBL5091131 0.79 AURKA (0.69) AURKAEGFRAURKBKDR
SCHEMBL5016588 0.79 AURKA (0.65) AURKAEGFRAURKBKDR
SCHEMBL5022873 0.78 AURKA (0.67) AURKAEGFRAURKBKDR
SCHEMBL5651656 0.77 EGFR (0.65) AURKAEGFRAURKBKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1575966-B1 THERAPEUTIC QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2008-10-29 EP disclosed
US-20060058325-A1 Therapeutic quniazoline derivatives ASTRAZENECA AB (SE) 2006-03-16 US disclosed
EP-1575966-A1 THERAPEUTIC QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2005-09-21 EP disclosed
WO-2004058782-A1 THERAPEUTIC QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2004-07-15 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-20060058325-A1 Therapeutic quniazoline derivatives NQO2, ABL1, CYP3A7 AURKA 376/4885EGFR 2724/4885AURKB 642/4885

“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.