SCHEMBL4421028

SCHEMBL4421028

COc1cc2c(Oc3ccc(F)cc3Br)ncnc2cc1C#CCN1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.48
KDR P35968 8/20 0.44
FLT1 P17948 6/20 0.44
FLT4 P35916 6/20 0.44
EGFR P00533 3/20 0.44
AXL P30530 2/20 0.44
SRC P12931 2/20 0.44
MET P08581 2/20 0.44
PLK4 O00444 1/20 0.44
GAK O14976 1/20 0.44
EPHB6 O15197 1/20 0.44
RIPK2 O43353 1/20 0.44
ERN1 O75460 1/20 0.44
STK10 O94804 1/20 0.44
MAP4K4 O95819 1/20 0.44
CHEK2 O96017 1/20 0.44
ABL1 P00519 1/20 0.44
ERBB2 P04626 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44

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
SCHEMBL4422009 0.83 TRPA1 (0.52) TRPA1KDRFLT1EGFRMET
SCHEMBL4427782 0.83 KDR (0.45) TRPA1KDRFLT1FLT4EGFR
SCHEMBL4416517 0.82 KDM4E (0.43) TRPA1KDRFLT1FLT4EGFR
SCHEMBL4686840 0.81 TRPA1 (0.49) TRPA1KDRFLT1EGFRMET
SCHEMBL4424919 0.81 KDR (0.60) TRPA1KDRFLT1FLT4EGFR
SCHEMBL4420738 0.80 KDR (0.66) TRPA1KDRFLT1FLT4EGFR
SCHEMBL4418189 0.77 TRPA1 (0.43) TRPA1KDRFLT1FLT4EGFR
SCHEMBL4430446 0.77 EHMT2 (0.46) KDRSRCMAP4K4KITEPHB4
SCHEMBL4419758 0.74 TRPA1 (0.62) TRPA1KDREGFRMETLCK
SCHEMBL4419529 0.74 KDR (0.60) TRPA1KDRFLT1FLT4EGFR

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-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-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 TRPA1 2378/4885KDR 39/4885FLT1 3/4885

“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.