SCHEMBL4421074

SCHEMBL4421074

COc1cc2c(NC(=O)Nc3c(F)cccc3F)ncnc2cc1OCCCN1CCC(CN)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.57
EGFR P00533 8/20 0.57
BRAF P15056 2/20 0.57
AURKA O14965 6/20 0.56
RET P07949 4/20 0.54
AURKB Q96GD4 2/20 0.54
IGF1R P08069 1/20 0.54
FGFR1 P11362 1/20 0.54
SRC P12931 1/20 0.54
FGFR2 P21802 1/20 0.54
FGFR4 P22455 1/20 0.54
FGFR3 P22607 1/20 0.54
CDK2 P24941 1/20 0.54
CSK P41240 1/20 0.54
JAK3 P52333 1/20 0.54
PTK2 Q05397 1/20 0.54
KIF5B P33176 2/20 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
SCHEMBL4418947 0.92 EGFR (0.60) KDREGFRBRAFAURKAAURKB
SCHEMBL4417552 0.91 EGFR (0.59) KDREGFRBRAFAURKA
SCHEMBL5496174 0.89 EGFR (0.69) KDREGFRBRAFRETFGFR1
SCHEMBL4422030 0.88 EGFR (0.57) KDREGFRBRAFAURKA
SCHEMBL5498285 0.88 BRAF (0.70) KDREGFRBRAFAURKARET
SCHEMBL5500589 0.87 AURKA (0.54) KDREGFRBRAFAURKARET
SCHEMBL4425294 0.84 KDR (0.70) KDREGFRRETAURKBFGFR1
SCHEMBL4687801 0.80 RET (0.66) KDREGFRAURKARETFGFR1
SCHEMBL5496725 0.80 KDR (0.62) KDREGFRBRAFAURKARET
SCHEMBL5500057 0.80 EGFR (0.71) KDREGFRBRAFRETFGFR1

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 8 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
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

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 KDR 39/4885EGFR 1578/4885BRAF 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.