SCHEMBL4548771

SCHEMBL4548771

CNC(=O)c1cc(Oc2ccc3c(NC(=O)c4cccc5ccccc45)cccc3c2)ccn1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.72
PDGFRA P16234 1/20 0.53
MET P08581 2/20 0.52
AURKA O14965 1/20 0.52
LCK P06239 1/20 0.52
TEK Q02763 1/20 0.52
AURKB Q96GD4 1/20 0.52
FGFR1 P11362 7/20 0.51
BRAF P15056 3/20 0.51
FGFR2 P21802 1/20 0.50
FGFR3 P22607 1/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 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
SCHEMBL2747772 0.91 KDR (0.70) KDRPDGFRAMETAURKALCK
SCHEMBL2747429 0.90 KDR (0.64) KDRPDGFRAMETAURKALCK
SCHEMBL2750437 0.90 KDR (0.68) KDRPDGFRAMETAURKALCK
SCHEMBL4548756 0.89 KDR (0.64) KDRMETAURKALCKAURKB
SCHEMBL2746993 0.88 KDR (0.84) KDRMETFGFR1BRAF
SCHEMBL2746237 0.88 KDR (0.60) KDRMETFGFR1BRAF
SCHEMBL4548758 0.85 KDR (0.59) KDRFGFR1BRAFFGFR2FGFR3
SCHEMBL2747996 0.84 KDR (0.71) KDRMETAURKALCKTEK
SCHEMBL2747087 0.84 SIRT2 (0.62) KDRFGFR1BRAFFGFR2FGFR3
SCHEMBL4548770 0.84 KDR (0.58) KDRAURKALCKAURKBFGFR1

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 354/4885PDGFRA 49/4885MET 3/4885
US-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885PDGFRA 49/4885MET 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.