SCHEMBL4548914

SCHEMBL4548914

COc1ccc(NC(=O)c2cccc3cc(Oc4ncnc5[nH]ccc45)ccc23)cc1

nearest known ligand 0.83

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.83
AURKA O14965 4/20 0.52
MET P08581 4/20 0.52
TEK Q02763 4/20 0.52
AURKB Q96GD4 4/20 0.52
BRAF P15056 2/20 0.52
MAPK14 Q16539 1/20 0.52
TNNI3K Q59H18 1/20 0.52
LCK P06239 1/20 0.51
CSF1R P07333 1/20 0.51
FLT1 P17948 1/20 0.51
FGFR2 P21802 1/20 0.51
FLT4 P35916 1/20 0.51
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50

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
SCHEMBL4548938 0.94 KDR (0.76) KDRAURKAMETTEKAURKB
SCHEMBL4548917 0.93 KDR (0.75) KDRAURKAMETTEKAURKB
SCHEMBL4548913 0.93 KDR (0.83) KDRAURKAMETTEKAURKB
SCHEMBL4548912 0.92 KDR (0.84) KDRBRAFMAPK14TNNI3KFLT1
SCHEMBL4812261 0.91 KDR (1.00) KDRAURKAMETTEKAURKB
SCHEMBL2748018 0.90 KDR (0.79) KDRMETBRAFMAPK14TNNI3K
SCHEMBL4548925 0.90 KDR (0.82) KDRAURKAMETTEKAURKB
SCHEMBL4548939 0.89 KDR (0.77) KDRAURKAMETTEKAURKB
SCHEMBL4548950 0.88 KDR (0.79) KDRMETBRAFMAPK14TNNI3K
SCHEMBL4548909 0.88 KDR (0.79) KDRBRAFMAPK14TNNI3KCSF1R

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 10 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
EP-1713484-A2 COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2006-10-25 EP disclosed
WO-2005070891-A2 COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2005-08-04 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 (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 4148/4885MET 3/4885
US-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885AURKA 4148/4885MET 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.