SCHEMBL4548701

SCHEMBL4548701

COc1cc2c(Oc3ccc4c(C(=O)Nc5cc(C(C)(C)C)[nH]n5)cccc4c3)ccnc2cc1OCCCN1CCOCC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.60
CYP3A4 P08684 2/20 0.56
AURKA O14965 9/20 0.55
LCK P06239 9/20 0.55
TEK Q02763 9/20 0.55
MET P08581 9/20 0.55
AURKB Q96GD4 5/20 0.54
FLT1 P17948 2/20 0.54
CSF1R P07333 1/20 0.54
BRAF P15056 1/20 0.54
FGFR2 P21802 1/20 0.54
FLT4 P35916 1/20 0.54
CYP2D6 P10635 1/20 0.53
LYN P07948 1/20 0.53

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
SCHEMBL4548692 0.89 KDR (0.77) KDRCYP3A4AURKALCKTEK
SCHEMBL2747644 0.88 KDR (0.57) KDRCYP3A4AURKALCKTEK
SCHEMBL4548831 0.88 KDR (0.73) KDRCYP3A4AURKALCKTEK
SCHEMBL4548694 0.87 KDR (0.75) KDRCYP3A4AURKALCKTEK
SCHEMBL14018164 0.87 KDR (0.63) KDRCYP3A4AURKALCKTEK
SCHEMBL2747757 0.86 KDR (0.63) KDRCYP3A4AURKALCKTEK
SCHEMBL2747456 0.86 KDR (0.61) KDRCYP3A4AURKALCKTEK
SCHEMBL14018227 0.85 KDR (0.62) KDRCYP3A4AURKALCKTEK
SCHEMBL4548697 0.85 FLT3 (0.68) KDRCYP3A4AURKALCKTEK
SCHEMBL2747540 0.85 KDR (0.61) KDRCYP3A4AURKALCKTEK

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 6 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885CYP3A4 348/4885AURKA 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.