SCHEMBL7209612

SCHEMBL7209612

COc1cc2c(Oc3ccccc3)ncnc2cc1OCCN1CCOCC1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.62
RAF1 P04049 7/20 0.61
BRAF P15056 5/20 0.61
MAP2K1 Q02750 2/20 0.61
SRC P12931 3/20 0.59
AURKA O14965 3/20 0.59
KDR P35968 5/20 0.59
EPHA2 P29317 1/20 0.57
EPHB4 P54760 1/20 0.57
FLT4 P35916 3/20 0.56
PDGFRB P09619 2/20 0.56
TEK Q02763 2/20 0.56
AURKB Q96GD4 2/20 0.56
MAPK3 P27361 1/20 0.55
MAPK1 P28482 1/20 0.55
FGFR1 P11362 1/20 0.55
FLT1 P17948 1/20 0.55
FGFR2 P21802 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
SCHEMBL17278101 0.95 SRC (0.66) EGFRRAF1BRAFMAP2K1SRC
SCHEMBL4023679 0.95 SRC (0.66) EGFRRAF1BRAFMAP2K1SRC
SCHEMBL5501376 0.91 KDR (0.66) EGFRRAF1BRAFSRCAURKA
SCHEMBL29631554 0.90 SRC (0.60) EGFRRAF1BRAFMAP2K1SRC
SCHEMBL4377465 0.90 KDR (0.65) EGFRRAF1BRAFSRCAURKA
SCHEMBL7211076 0.90 KDR (0.66) EGFRRAF1BRAFAURKAKDR
SCHEMBL1012845 0.90 BRAF (0.62) EGFRRAF1BRAFSRCKDR
SCHEMBL7209933 0.88 AURKA (0.59) EGFRRAF1BRAFAURKAKDR
SCHEMBL19258467 0.88 AURKA (0.62) RAF1BRAFAURKAKDRFLT4
SCHEMBL17278095 0.88 BRAF (0.70) EGFRRAF1BRAFSRCKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0880508-B1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2003-04-16 EP disclosed
US-6184225-B1 ENDOTHELIAL GROWTH FACTOR INHIBITORS, ANGIOGENESIS INHIBITORS ZENECA LIMITED (GB) 2001-02-06 US disclosed
EP-0880508-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ZENECA LIMITED (GB) 1998-12-02 EP disclosed
WO-1997030035-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ZENECA LIMITED (GB) 1997-08-21 WO disclosed