SCHEMBL4375005

SCHEMBL4375005

COc1cc2c(Nc3ccc4[nH]c(C)c(C)c4c3)ncnc2cc1OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 6/20 0.63
EGFR P00533 13/20 0.62
KDR P35968 6/20 0.57
RET P07949 1/20 0.57
EPHA2 P29317 4/20 0.56
LCK P06239 2/20 0.56
EPHB4 P54760 3/20 0.55
FLT1 P17948 1/20 0.55
CLK1 P49759 1/20 0.54
ABCG2 Q9UNQ0 1/20 0.54
RIPK2 O43353 1/20 0.54
EPHB2 P29323 1/20 0.54
GAK O14976 1/20 0.54

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
SCHEMBL4379803 0.86 MAPK1 (0.55) ERBB2EGFRKDRRETEPHA2
SCHEMBL4382070 0.85 KDR (0.60) ERBB2EGFRKDRRETEPHA2
Hydrochloric Acid SCHEMBL4377824 0.84 ERBB2 (0.65) ERBB2EGFRKDRRETEPHA2
SCHEMBL4378175 0.84 KDR (0.59) EGFRKDRRETLCKFLT1
SCHEMBL6099428 0.84 EGFR (0.65) ERBB2EGFRKDRRETLCK
SCHEMBL1387156 0.83 EGFR (0.75) ERBB2EGFRKDRRETEPHA2
SCHEMBL30891782 0.83 EGFR (0.83) ERBB2EGFRKDRRETLCK
SCHEMBL4378200 0.82 KDR (0.62) EGFRKDRRETLCKFLT1
SCHEMBL6031335 0.82 EGFR (0.58) EGFRKDRRETLCKFLT1
Hydrochloric Acid SCHEMBL8811182 0.82 EGFR (0.76) ERBB2EGFRKDRRETEPHA2

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-8492560-B2 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2013-07-23 US disclosed
US-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors STOKES ELAINE S E (GB) 2012-08-02 US disclosed
EP-2050744-A1 Quinazoline derivatives as angiogenesis inhibitors AstraZeneca AB (SE) 2009-04-22 EP disclosed
US-7074800-B1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2006-07-11 US disclosed
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB 2006-01-05 US disclosed
EP-1553097-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AND INTERMEDIATES THEREFORE AstraZeneca AB (SE) 2005-07-13 EP disclosed
EP-1154774-B1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2005-06-22 EP disclosed
EP-1154774-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2001-11-21 EP disclosed
WO-2000047212-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2000-08-17 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 (2 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-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors VEGFA, FLT1, KDR ERBB2 1869/4885EGFR 500/4885KDR 3/4885
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors FLT4, NOS3, FLT1 ERBB2 787/4885EGFR 549/4885KDR 4/4885

“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.