SCHEMBL4548906

SCHEMBL4548906

COc1cccc(NC(=O)c2cccc3cc(Oc4ccnc(C(N)=O)c4)ccc23)c1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.63
AURKA O14965 1/20 0.55
MET P08581 1/20 0.55
TEK Q02763 1/20 0.55
AURKB Q96GD4 1/20 0.55
PDGFRA P16234 1/20 0.54
CYP3A4 P08684 2/20 0.53
CYP2D6 P10635 2/20 0.53
RET P07949 1/20 0.52
PDGFRB P09619 1/20 0.52
KIT P10721 1/20 0.52
FLT1 P17948 1/20 0.52
FLT4 P35916 1/20 0.52

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
SCHEMBL2747497 0.91 KDR (0.75) KDRAURKAMETTEKAURKB
SCHEMBL4548907 0.90 KDR (0.62) KDRCYP3A4CYP2D6RETPDGFRB
SCHEMBL2748558 0.88 KDR (0.56) KDRRETPDGFRBKITFLT1
SCHEMBL4548903 0.88 KDR (0.68) KDRAURKAMETTEKAURKB
SCHEMBL4548899 0.86 KDR (0.75) KDRCYP3A4CYP2D6
SCHEMBL2439211 0.85 KDR (0.72) KDRAURKAAURKBRETPDGFRB
SCHEMBL2747607 0.84 KDR (0.76) KDRAURKAMETTEKAURKB
SCHEMBL2748623 0.83 KDR (0.84) KDRAURKAMETTEKAURKB
SCHEMBL29258978 0.82 KDR (0.81) KDRAURKAMETTEKAURKB
SCHEMBL2746993 0.81 KDR (0.84) KDRMETRETFLT1

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.