SCHEMBL4480888

SCHEMBL4480888

CC(=O)N(C)CCOc1cccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c12

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.63
ERBB2 P04626 16/20 0.63
GAK O14976 1/20 0.57
ERBB4 Q15303 4/20 0.55
ERBB3 P21860 1/20 0.55
JAK3 P52333 1/20 0.55
HDAC3 O15379 1/20 0.55
HDAC4 P56524 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC7 Q8WUI4 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC10 Q969S8 1/20 0.55
HDAC11 Q96DB2 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
HDAC9 Q9UKV0 1/20 0.55
HDAC5 Q9UQL6 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
SCHEMBL4478600 0.92 EGFR (0.75) EGFRERBB2GAKERBB4ERBB3
SCHEMBL3807511 0.90 EGFR (0.66) EGFRERBB2GAKERBB4ERBB3
SCHEMBL3807553 0.89 ERBB2 (0.65) EGFRERBB2GAKERBB4ERBB3
SCHEMBL3815330 0.88 EGFR (0.65) EGFRERBB2GAKERBB4ERBB3
SCHEMBL4481271 0.88 ERBB2 (0.65) EGFRERBB2
SCHEMBL4480007 0.87 ERBB2 (0.67) EGFRERBB2GAKERBB4ERBB3
SCHEMBL3811890 0.87 EGFR (0.67) EGFRERBB2GAKERBB4ERBB3
Trifluoroacetic Acid SCHEMBL3816939 0.87 EGFR (0.58) EGFRERBB2GAKERBB4ERBB3
SCHEMBL3815062 0.85 EGFR (0.70) EGFRERBB2GAKERBB4ERBB3
SCHEMBL4481487 0.85 ERBB2 (0.85) EGFRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7625908-B2 Quinazoline derivatives ASTRAZENECA AB (SE) 2009-12-01 US claimed
US-20070244136-A1 Quinazoline Derivatives ASTRAZENECA AB (SE) 2007-10-18 US claimed
JP-2007511491-A 2007-05-10 JP claimed
EP-1685116-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2006-08-02 EP claimed
WO-2005051923-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-06-09 WO claimed
US-7625908-B2 Quinazoline derivatives ASTRAZENECA AB (SE) 2009-12-01 US disclosed
US-20070244136-A1 Quinazoline Derivatives ASTRAZENECA AB (SE) 2007-10-18 US disclosed
EP-1685116-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2006-08-02 EP disclosed
WO-2005051923-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-06-09 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-20070244136-A1 Quinazoline Derivatives ERBB2, ABL1, MKI67 EGFR 10/4885ERBB2 1/4885GAK 316/4885

“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.