SCHEMBL5567993

SCHEMBL5567993

C#Cc1cc(Nc2ncnc3cc(OC)c(OC4CCNCC4)cc23)ccc1OCc1cccc(F)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.61
GAK O14976 2/20 0.61
ERBB2 P04626 6/20 0.57
FBP1 P09467 2/20 0.55
LCK P06239 1/20 0.51
ERBB4 Q15303 1/20 0.51
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
EPHA2 P29317 2/20 0.49
KDR P35968 2/20 0.49
EPHB4 P54760 2/20 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
SCHEMBL12743451 0.89 EGFR (0.79) EGFRGAKERBB2ERBB4HDAC3
Hydrochloric Acid SCHEMBL1446356 0.88 EGFR (0.78) EGFRGAKERBB2ERBB4HDAC3
SCHEMBL5567887 0.88 EGFR (0.61) EGFRGAKERBB2FBP1ERBB4
SCHEMBL29623603 0.80 EGFR (0.75) EGFRGAKERBB2FBP1LCK
SCHEMBL185543 0.80 EGFR (0.75) EGFRGAKERBB2FBP1LCK
SCHEMBL29087931 0.80 EGFR (0.64) EGFRGAKERBB2FBP1EPHA2
SCHEMBL30638099 0.80 EGFR (0.64) EGFRGAKERBB2FBP1EPHA2
SCHEMBL1446486 0.80 EGFR (0.79) EGFRGAKERBB2ERBB4HDAC3
Hydrochloric Acid SCHEMBL1446303 0.80 EGFR (0.74) EGFRGAKERBB2FBP1LCK
Hydrochloric Acid SCHEMBL4085852 0.80 EGFR (0.74) EGFRGAKERBB2FBP1LCK

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-20070032508-A1 Quinazoline derivatives as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2007-02-08 US disclosed
EP-1664028-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS AstraZeneca AB (SE) 2006-06-07 EP disclosed
WO-2005026151-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2005-03-24 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-20070032508-A1 Quinazoline derivatives as tyrosine kinase inhibitors ABL1, ERBB2, LCK EGFR 15/4885GAK 289/4885ERBB2 2/4885

“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.