SCHEMBL4548741

SCHEMBL4548741

COc1cc2nccc(Oc3ccc4c(C(=O)NCC(N)=O)cccc4c3F)c2cc1OC

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.69
AURKA O14965 12/20 0.56
TEK Q02763 12/20 0.56
LCK P06239 11/20 0.56
MET P08581 10/20 0.56
AURKB Q96GD4 9/20 0.56
LYN P07948 3/20 0.55
FLT1 P17948 1/20 0.55
ABL1 P00519 2/20 0.52
FGR P09769 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
SRC P12931 1/20 0.48
TGFBR1 P36897 1/20 0.48

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
SCHEMBL2748514 0.90 KDR (0.72) KDRAURKATEKLCKMET
SCHEMBL4548746 0.90 KDR (0.67) KDRAURKATEKLCKMET
SCHEMBL2749314 0.88 KDR (0.70) KDRAURKATEKLCKMET
SCHEMBL4548747 0.88 KDR (0.69) KDRAURKATEKLCKMET
SCHEMBL4548740 0.88 KDR (0.72) KDRAURKATEKLCKMET
SCHEMBL2747740 0.87 KDR (0.75) KDRAURKATEKLCKMET
SCHEMBL2749249 0.87 KDR (0.69) KDRAURKATEKLCKMET
SCHEMBL4548748 0.85 KDR (0.73) KDRAURKATEKLCKMET
SCHEMBL2748848 0.84 KDR (0.70) KDRAURKATEKLCKMET
SCHEMBL2747336 0.84 KDR (0.85) KDRAURKATEKLCKMET

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-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 US disclosed
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 US disclosed
US-20060241115-A1 Compounds and methods of use AMGEN INC. 2006-10-26 US 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 (2 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-20060241115-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885AURKA 4148/4885TEK 184/4885
US-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885AURKA 4148/4885TEK 184/4885

“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.