SCHEMBL4418947

SCHEMBL4418947

COc1cc2c(NC(=O)Nc3c(C)cccc3C)ncnc2cc1OCCCN1CCC(CN)CC1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.60
KDR P35968 13/20 0.60
BRAF P15056 3/20 0.58
AURKA O14965 5/20 0.53
AURKB Q96GD4 2/20 0.52
IGF1R P08069 1/20 0.52
FGFR1 P11362 1/20 0.52
SRC P12931 1/20 0.52
FGFR2 P21802 1/20 0.52
FGFR4 P22455 1/20 0.52
FGFR3 P22607 1/20 0.52
CDK2 P24941 1/20 0.52
CSK P41240 1/20 0.52
JAK3 P52333 1/20 0.52
PTK2 Q05397 1/20 0.52
RAF1 P04049 1/20 0.51

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
SCHEMBL4422030 0.95 EGFR (0.57) EGFRKDRBRAFAURKA
SCHEMBL4417552 0.92 EGFR (0.59) EGFRKDRBRAFAURKA
SCHEMBL4421074 0.92 KDR (0.57) EGFRKDRBRAFAURKAAURKB
SCHEMBL5500057 0.89 EGFR (0.71) EGFRKDRBRAFFGFR1
SCHEMBL5496725 0.89 KDR (0.62) EGFRKDRBRAFAURKA
SCHEMBL5494771 0.87 EGFR (0.53) EGFRKDRBRAFAURKAAURKB
SCHEMBL5496194 0.84 KDR (0.67) EGFRKDRFGFR1
SCHEMBL4431208 0.83 EGFR (0.53) EGFRKDRBRAFAURKA
SCHEMBL5496174 0.80 EGFR (0.69) EGFRKDRBRAFFGFR1
SCHEMBL6774801 0.79 EGFR (0.51) EGFRKDRBRAFAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498335-B2 Method of producing an antiangiogenic or vascular permeability reducing effect ASTRAZENECA AB (CH) 2009-03-03 US disclosed
EP-1218353-B1 QUINAZOLINE DERIVATIVES ASTRAZENECA UK LTD (GB) 2007-10-17 EP disclosed
EP-1272185-B1 USE OF QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2005-07-27 EP disclosed
US-6806274-B1 IMMUNOREGULATION OR IMMUNOSUPPRESSIVE AGENTS; TYROSINE KINASE INHIBITORS; PREVENTING ORGAN TRANSPLANT REJECTION; AUTOIMMUNE CONDITIONS; REDUCED SIDE EFFECTS ASTRAZENECA UK LIMITED (GB) 2004-10-19 US disclosed
US-20030225111-A1 Therapy ASTRAZENECA AB (SE) 2003-12-04 US disclosed
EP-1272185-A2 USE OF QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2003-01-08 EP disclosed
EP-1218353-A1 QUINAZOLINE DERIVATIVES AstraZeneca UK Limited (GB) 2002-07-03 EP disclosed
WO-2002002534-A1 QUINAZOLINES WITH THERAPEUTIC USE ASTRAZENECA AB (SE) 2002-01-10 WO disclosed
WO-2001066099-A2 USE OF QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2001-09-13 WO disclosed
WO-2001004102-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 2001-01-18 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-20030225111-A1 Therapy VEGFA, AQP1, FLT1 EGFR 1578/4885KDR 39/4885BRAF 1862/4885

“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.