SCHEMBL5221992

SCHEMBL5221992

COc1cc2c(Nc3cccc4c3OCO4)ncnc2cc1OC[C@H]1CO1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.66
SRC P12931 3/20 0.66
EPHA2 P29317 14/20 0.55
EPHB4 P54760 8/20 0.55
CSK P41240 1/20 0.55
TEK Q02763 1/20 0.55
RET P07949 2/20 0.52
ERBB2 P04626 5/20 0.51
EGFR P00533 1/20 0.51
FLT1 P17948 2/20 0.51
KIF5B P33176 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
SCHEMBL3196499 0.85 KDR (0.76) KDRSRCEPHA2EPHB4CSK
SCHEMBL5217228 0.85 SRC (0.73) KDRSRCEPHB4CSKTEK
SCHEMBL5214357 0.85 SRC (0.75) KDRSRCEPHB4CSKTEK
SCHEMBL5215250 0.85 KDR (0.75) KDRSRCEPHA2EPHB4CSK
SCHEMBL5215259 0.85 KDR (0.75) KDRSRCEPHA2EPHB4CSK
Hydrochloric Acid SCHEMBL5222294 0.84 KDR (0.67) KDRSRCRETEGFRFLT1
Hydrochloric Acid SCHEMBL5215666 0.84 KDR (0.68) KDRSRCEPHB4CSKRET
SCHEMBL4489459 0.83 SRC (0.56) SRCERBB2EGFR
SCHEMBL6882002 0.82 SRC (0.67) KDRSRCEPHA2EPHB4RET
SCHEMBL6881994 0.82 SRC (0.67) KDRSRCEPHA2EPHB4RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1453492-B1 USE OF QUINAZOLINES TO TREAT T-CELL MEDIATED DISEASES ASTRAZENECA AB (SE) 2007-01-24 EP disclosed
US-7115615-B2 Quinazoline derivatives ASTRAZENECA (SE) 2006-10-03 US disclosed
EP-1453492-A2 USE OF QUINAZOLINES TO TREAT T-CELL MEDIATED DISEASES Astrazeneca AB (SE) 2004-09-08 EP disclosed
US-20040034046-A1 Quinazoline derivatives ASTRAZENECA AB (SE) 2004-02-19 US disclosed
WO-2003045364-A2 USE OF QUINAZOLINES TO TREAT T-CELL MEDIATED DISEASES ASTRAZENECA AB (SE) 2003-06-05 WO disclosed
EP-1313727-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2003-05-28 EP disclosed
WO-2002016352-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-02-28 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-20040034046-A1 Quinazoline derivatives NQO2, NRAS, TOP1 KDR 1995/4885SRC 2619/4885EPHA2 3431/4885

“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.