SCHEMBL4548932

SCHEMBL4548932

CC(C)NC(=O)c1cccc2cc(Oc3ncnc4[nH]ccc34)ccc12

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.70
MET P08581 6/20 0.53
AURKA O14965 5/20 0.53
TEK Q02763 5/20 0.53
AURKB Q96GD4 5/20 0.53
LCK P06239 2/20 0.53
TNNI3K Q59H18 2/20 0.50
TRPA1 O75762 4/20 0.49
BRAF P15056 1/20 0.46
MAPK14 Q16539 1/20 0.46
ROCK2 O75116 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP3A5 P20815 1/20 0.44
LIMK1 P53667 1/20 0.44
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42

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
SCHEMBL4548929 0.90 KDR (0.73) KDRMETAURKATEKAURKB
SCHEMBL4548930 0.87 KDR (0.69) KDRMETAURKATEKAURKB
SCHEMBL2747018 0.86 KDR (0.71) KDRMETAURKATEKAURKB
SCHEMBL4548926 0.86 KDR (0.73) KDRMETAURKATEKAURKB
SCHEMBL4548925 0.86 KDR (0.82) KDRMETAURKATEKAURKB
SCHEMBL2747911 0.85 KDR (0.72) KDRMETAURKATEKAURKB
SCHEMBL4548931 0.85 KDR (0.67) KDRMETAURKATEKAURKB
SCHEMBL4548912 0.85 KDR (0.84) KDRTNNI3KTRPA1BRAFMAPK14
SCHEMBL4548914 0.85 KDR (0.83) KDRMETAURKATEKAURKB
SCHEMBL4548943 0.85 KDR (0.66) KDRMETAURKATEKAURKB

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 354/4885MET 3/4885AURKA 4148/4885
US-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885MET 3/4885AURKA 4148/4885

“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.